Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 12/20 | 0.45 |
| ▸ | CHRNA3 | P32297 | 12/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 2/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | NOS2 | P35228 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2388999 | 0.98 | CHRNB4 (0.44) | CHRNB4CHRNA3ALOX15SMN1; SMN2CHRNA7 | |
| SCHEMBL1697263 | 0.98 | CHRNB4 (0.44) | CHRNB4CHRNA3ALOX15SMN1; SMN2CHRNA7 | |
| SCHEMBL2331460 | 0.98 | CHRNB4 (0.44) | CHRNB4CHRNA3ALOX15SMN1; SMN2CHRNA7 | |
| SCHEMBL3141751 | 0.98 | CHRNB4 (0.44) | CHRNB4CHRNA3ALOX15SMN1; SMN2CHRNA7 | |
| SCHEMBL1697262 | 0.98 | CHRNB4 (0.44) | CHRNB4CHRNA3ALOX15SMN1; SMN2CHRNA7 | |
| SCHEMBL2331456 | 0.98 | CHRNB4 (0.44) | CHRNB4CHRNA3ALOX15SMN1; SMN2CHRNA7 | |
| SCHEMBL2388996 | 0.98 | CHRNB4 (0.44) | CHRNB4CHRNA3ALOX15SMN1; SMN2CHRNA7 | |
| Bromide SCHEMBL28412921 | 0.96 | CHRNB4 (0.42) | CHRNB4CHRNA3ALOX15SMN1; SMN2CHRNA7 | |
| SCHEMBL4771296 | 0.96 | CHRNB4 (0.41) | CHRNB4CHRNA3ALOX15SMN1; SMN2TDP1 | |
| Bicarbonate SCHEMBL9626193 | 0.89 | CHRNB4 (0.42) | CHRNB4CHRNA3ALOX15SMN1; SMN2CHRNA7 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109937038-A | Dicyclic nitrogen-containing heterocycle compound | 田边三菱制药株式会社 | 2019-06-25 | — | — | CN | disclosed |
| US-5284970-A | Phosphonation with phosphorus trihalides or phosphonic acid diesters | AMERICAN CYANAMID COMPANY (US) | 1994-02-08 | — | — | US | disclosed |
| US-5149825-A | Chemical intermediates for herbicides | AMERICAN CYANAMID COMPANY (US) | 1992-09-22 | — | — | US | disclosed |
| EP-0374410-A2 | 2-Azabicyclo[2.2.1]hept-5-ene-2-acetic acid, derivatives thereof and related compounds, process for the preparation of said compounds and the use of said compounds for the manufacture of N-phosphonomethylglycine | AMERICAN CYANAMID COMPANY (US) | 1990-06-27 | — | — | EP | disclosed |
| EP-0012470-B1 | ISOMERISATION OF PYRROLIDINE DERIVATIVES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1982-11-24 | — | — | EP | disclosed |
| EP-0012471-B1 | AZABICYCLOHEXENE DERIVATIVES, A PROCESS FOR PREPARING THEM, POLLEN-SUPPRESSING COMPOSITIONS, A METHOD OF PRODUCING F1 HYBRID SEED, AND SEED THUS PRODUCED | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1982-10-06 | — | — | EP | disclosed |
| US-4249936-A | POLLEN INHIBITORS | SHELL OIL COMPANY (US) | 1981-02-10 | — | — | US | disclosed |
| EP-0012470-A1 | Isomerisation of pyrrolidine derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1980-06-25 | — | — | EP | disclosed |
| EP-0012471-A1 | Azabicyclohexene derivatives, a process for preparing them, pollen-suppressing compositions, a method of producing F1 hybrid seed, and seed thus produced | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1980-06-25 | — | — | EP | disclosed |
| EP-0012471-A1 | Azabicyclohexene derivatives, a process for preparing them, pollen-suppressing compositions, a method of producing F1 hybrid seed, and seed thus produced | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1980-06-25 | — | — | EP | disclosed |