Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Methacholine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 known ✓ | P20309 | 3/20 | 0.63 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.95 |
| ▸ | TSHR | P16473 | 3/20 | 0.95 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.95 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.95 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.95 |
| ▸ | MAPT | P10636 | 3/20 | 0.91 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.91 |
| ▸ | GALR3 | O60755 | 2/20 | 0.91 |
| ▸ | BLM | P54132 | 1/20 | 0.91 |
| ▸ | LMNA | P02545 | 3/20 | 0.63 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Methacholine SCHEMBL1539028 | 1.00 | CHRM1 (0.95) | CHRM1TSHRCHRM2CHRM4TBXA2R | |
| Methacholine SCHEMBL24465400 | 0.98 | CHRM1 (1.00) | CHRM1TSHRCHRM2CHRM4TBXA2R | |
| Methacholine SCHEMBL69103 | 0.98 | CHRM1 (1.00) | CHRM1TSHRCHRM2CHRM4TBXA2R | |
| Methacholine SCHEMBL2349212 | 0.95 | CHRM1 (0.95) | CHRM1TSHRCHRM2CHRM4TBXA2R | |
| Methacholine SCHEMBL16340808 | 0.95 | CHRM1 (0.95) | CHRM1TSHRCHRM2CHRM4TBXA2R | |
| Methacholine SCHEMBL1256548 | 0.95 | CHRM1 (0.95) | CHRM1TSHRCHRM2CHRM4TBXA2R | |
| Methacholine SCHEMBL69104 | 0.95 | MAPT (1.00) | CHRM1TSHRCHRM2CHRM4TBXA2R | |
| Methacholine SCHEMBL1536636 | 0.87 | TSHR (0.72) | CHRM1TSHRCHRM2CHRM4TBXA2R | |
| Methacholine SCHEMBL584417 | 0.86 | CHRM1 (0.70) | CHRM1TSHRCHRM2CHRM4TBXA2R | |
| SCHEMBL12743772 | 0.84 | MAPT (0.79) | CHRM1TSHRCHRM2CHRM4TBXA2R |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 57 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2828301-A1 | MODIFIED POLYMER COMPOSITIONS | Styron Europe GmbH (CH) | 2015-01-28 | — | — | EP | claimed |
| WO-2013139378-A1 | MODIFIED POLYMER COMPOSITIONS | STYRON EUROPE GMBH (CH) | 2013-09-26 | — | — | WO | claimed |
| WO-2023118282-A1 | TIRE ELASTOMERIC COMPOSITIONS COMPRISING A PRECIPITATED SILICA | RHODIA OPERATIONS (FR) | 2023-06-29 | — | — | WO | disclosed |
| WO-2023118286-A1 | TIRE ELASTOMERIC COMPOSITIONS COMPRISING A PRECIPITATED SILICA | RHODIA OPERATIONS (FR) | 2023-06-29 | — | — | WO | disclosed |
| EP-4004064-A1 | HYDROCARBON POLYMER MODIFIERS HAVING HIGH AROMATICITY AND USES THEREOF | ExxonMobil Chemical Patents Inc. (US) | 2022-06-01 | — | — | EP | disclosed |
| EP-4004063-A1 | HYDROCARBON POLYMER MODIFIERS HAVING LOW AROMATICITY AND USES THEREOF | ExxonMobil Chemical Patents Inc. (US) | 2022-06-01 | — | — | EP | disclosed |
| EP-3802644-A1 | METALLOCENES WITH SI-SI BRIDGES | ExxonMobil Chemical Patents Inc. (US) | 2021-04-14 | — | — | EP | disclosed |
| EP-3784677-A1 | NON-COORDINATING ANION TYPE ACTIVATORS CONTAINING CATION HAVING LARGE ALKYL GROUPS | ExxonMobil Chemical Patents Inc. (US) | 2021-03-03 | — | — | EP | disclosed |
| WO-2021021416-A1 | HYDROCARBON POLYMER MODIFIERS HAVING LOW AROMATICITY AND USES THEREOF | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2021-02-04 | — | — | WO | disclosed |
| WO-2021021417-A1 | HYDROCARBON POLYMER MODIFIERS HAVING HIGH AROMATICITY AND USES THEREOF | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2021-02-04 | — | — | WO | disclosed |
| EP-3720908-A1 | ELASTOMERIC TERPOLYMER COMPOSITIONS FOR CORNER MOLDING APPLICATIONS | ExxonMobil Chemical Patents Inc. (US) | 2020-10-14 | — | — | EP | disclosed |
| WO-2010060550-A1 | PNEUMATIC TYRE HAVING A TOP AREA WITH A WATER BARRIER LAYER | SOCIETE DE TECHNOLOGIE MICHELIN (FR) | 2010-06-03 | — | — | WO | disclosed |
| WO-2010031077-A1 | INCREASED ISOPRENE PRODUCTION USING MEVALONATE KINASE AND ISOPRENE SYNTHASE | DANISCO US INC. (US) | 2010-03-18 | — | — | WO | disclosed |
| EP-1984411-A1 | MONOVINYLARENE CONJUGATED DIENE BLOCK COPOLYMER COMPOSITIONS FOR SHRINKABLE FILMS | Chevron Phillips Chemical Company LP (US) | 2008-10-29 | — | — | EP | disclosed |
| WO-2007087604-A1 | MONOVINYLARENE CONJUGATED DIENE BLOCK COPOLYMER COMPOSITIONS FOR SHRINKABLE FILMS | CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) | 2007-08-02 | — | — | WO | disclosed |
| EP-1114093-A1 | DIENE ELASTOMER AND REINFORCING TITANIUM OXIDE BASED RUBBER COMPOSITION FOR A PNEUMATIC TYRE | Société de Technologie Michelin (FR) | 2001-07-11 | — | — | EP | disclosed |
| WO-2001046201-A1 | GALLIUM OR INDIUM-BRIDGED GROUP 4 METAL COMPLEXES | THE DOW CHEMICAL COMPANY (US) | 2001-06-28 | — | — | WO | disclosed |
| EP-1102812-A1 | COUPLING SYSTEM (WHITE FILLER/DIENE ELASTOMER) BASED ON POLYSULPHIDE ALKOXYSILANE, ZINC DITHIOPHOSPHATE AND GUANIDINE DERIVATIVE | Société de Technologie Michelin (FR) | 2001-05-30 | — | — | EP | disclosed |
| WO-2000073372-A1 | DIENE ELASTOMER AND REINFORCING TITANIUM OXIDE BASED RUBBER COMPOSITION FOR A PNEUMATIC TYRE | SOCIETE DE TECHNOLOGIE MICHELIN (FR) | 2000-12-07 | — | — | WO | disclosed |
| WO-2000005301-A1 | COUPLING SYSTEM (WHITE FILLER/DIENE ELASTOMER) BASED ON POLYSULPHIDE ALKOXYSILANE, ZINC DITHIOPHOSPHATE AND GUANIDINE DERIVATIVE | SOCIETE DE TECHNOLOGIE MICHELIN (FR) | 2000-02-03 | — | — | WO | disclosed |