Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CASP7 | P55210 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | PRKCI | P41743 | 1/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL840263 | 0.84 | TSHR (0.42) | CASP1TSHRGAAMAPTHTT | |
| SCHEMBL18979299 | 0.83 | ESR1 (0.43) | TSHRGAAMAPTHTTMAPK1 | |
| SCHEMBL10448039 | 0.81 | CASP1 (0.40) | CASP1TSHRGAAMAPTHTT | |
| SCHEMBL21022055 | 0.81 | ALDH1A1 (0.40) | GAAHTTALDH1A1RIPK1L3MBTL1 | |
| SCHEMBL17726213 | 0.78 | ADRA2B (0.45) | CASP1TSHRGAAMAPTHTT | |
| SCHEMBL5491963 | 0.78 | CASP1 (0.50) | CASP1TSHRGAAMAPTHTT | |
| SCHEMBL29414153 | 0.78 | CASP1 (0.50) | CASP1TSHRGAAMAPTHTT | |
| SCHEMBL396816 | 0.78 | CASP1 (0.50) | CASP1TSHRGAAMAPTHTT | |
| SCHEMBL6447369 | 0.77 | TSHR (0.40) | CASP1TSHRGAAMAPTHTT | |
| SCHEMBL18386492 | 0.76 | ALDH1A1 (0.50) | CASP1TSHRGAAMAPTHTT |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4960941-A | HYDROGENATION CATALYST OF RHODIUM ON TITANIA SUPPORT | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1990-10-02 | — | — | US | claimed |
| EP-0244778-B1 | MONO-TERTIARY-ALKYLATED TOLUENEDIISO-CYANATES AND DERIVATIVES | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-10-16 | — | — | EP | disclosed |
| EP-0202557-B1 | PROCESS FOR PRODUCING MONOTERTIARY BUTYL TOLUENEDIAMINE | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-09-11 | — | — | EP | disclosed |
| EP-0370392-A1 | Process for the preparation of cyclohexanediisocyanate containing polyisocyanate prepolymers and polyurethanes having high temperature performance | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1990-05-30 | — | — | EP | disclosed |
| EP-0350681-A2 | Alkylation of toluenediamine and para-phenylenediamine with isobutylene in the presence of acidic, crystalline molecular sieves | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1990-01-17 | — | — | EP | disclosed |
| US-4855199-A | Photopatterned product of silicone polyamic acid on a transparent substrate | GENERAL ELECTRIC COMPANY (US) | 1989-08-08 | — | — | US | disclosed |
| US-4782009-A | Method of coating and imaging photopatternable silicone polyamic acid | GENERAL ELECTRIC COMPANY (US) | 1988-11-01 | — | — | US | disclosed |
| EP-0270031-A3 | TERTIARY BUTYL DERIVATIVES OF TOLUENEDIAMINE AND MIXTURES AS ANTIOXIDANT FOR ORGANIC MATERIALS | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1988-08-24 | — | — | EP | disclosed |
| EP-0272651-A2 | N-tert-butyl derivatives of toluenediamine and mixtures as antioxidant for organic materials | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1988-06-29 | — | — | EP | disclosed |
| EP-0270031-A2 | Tertiary butyl derivatives of toluenediamine and mixtures as antioxidant for organic materials | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1988-06-08 | — | — | EP | disclosed |
| EP-0270031-A2 | Tertiary butyl derivatives of toluenediamine and mixtures as antioxidant for organic materials | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1988-06-08 | — | — | EP | disclosed |
| EP-0244778-A1 | Mono-tertiary-alkylated toluenediiso-cyanates and derivatives | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1987-11-11 | — | — | EP | disclosed |