Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 1/20 | 0.46 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.46 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | VNN1 | O95497 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.39 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.39 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8350428 | 0.98 | ITGA4 (0.45) | ITGA4ITGB7AKR1C1OPRM1MEN1 | |
| SCHEMBL4825571 | 0.89 | AKR1C1 (0.53) | AKR1C1MEN1KMT2AALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL23778493 | 0.87 | AKR1C1 (0.52) | AKR1C1MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL7467936 | 0.86 | OPRM1 (0.45) | ITGA4ITGB7OPRM1MEN1KMT2A | |
| SCHEMBL9338162 | 0.85 | AKR1C1 (0.65) | ITGA4ITGB7AKR1C1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8347400 | 0.85 | OPRM1 (0.44) | ITGA4ITGB7OPRM1MEN1KMT2A | |
| SCHEMBL17896072 | 0.84 | AKR1C1 (0.62) | ITGA4ITGB7AKR1C1MEN1KMT2A | |
| SCHEMBL8638671 | 0.83 | KMT2A (0.41) | ITGA4ITGB7OPRM1MEN1KMT2A | |
| SCHEMBL373567 | 0.81 | AKR1C1 (0.68) | AKR1C1OPRM1KMT2AHDAC1HSD11B1 | |
| SCHEMBL7338024 | 0.80 | AKR1C1 (0.47) | AKR1C1OPRM1KMT2AALDH1A1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0946548-A1 | NOVEL HETEROCYCLIC SUBSTITUTED PYRROLIDINE AMIDE DERIVATIVES | HOECHST MARION ROUSSEL, INC. (US) | 1999-10-06 | — | — | EP | disclosed |
| US-5824690-A | TREATING ASTHMA, COUGH | HOECHST MARION ROUSSEL INC. (US) | 1998-10-20 | — | — | US | disclosed |
| WO-1998027086-A1 | NOVEL HETEROCYCLIC SUBSTITUTED PYRROLIDINE AMIDE DERIVATIVES | HOECHST MARION ROUSSEL, INC. (US) | 1998-06-25 | — | — | WO | disclosed |