Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | AOC3 | Q16853 | 4/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19129470 | 0.87 | TAAR1 (0.58) | AOC3SIGMAR1TAAR1 | |
| SCHEMBL3874218 | 0.84 | SIGMAR1 (0.53) | MAOAAOC3SIGMAR1HTR2ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL31687522 | 0.83 | SIGMAR1 (0.51) | MAOAAOC3SIGMAR1HTR2ASMN1; SMN2 | |
| SCHEMBL14065247 | 0.80 | TAAR1 (0.50) | AOC3SIGMAR1TAAR1 | |
| SCHEMBL9114952 | 0.79 | ALDH1A1 (0.49) | AOC3SIGMAR1TAAR1HTR2ASMN1; SMN2 | |
| SCHEMBL26239740 | 0.79 | AOC3 (0.56) | AOC3SIGMAR1TAAR1 | |
| SCHEMBL26243215 | 0.77 | SIGMAR1 (0.57) | AOC3SIGMAR1 | |
| SCHEMBL8179163 | 0.77 | AOC3 (0.54) | MAOAAOC3SIGMAR1TAAR1CYP2A6 | |
| SCHEMBL9459857 | 0.77 | CHRM2 (0.38) | — | |
| SCHEMBL14064920 | 0.77 | AOC3 (0.62) | AOC3SIGMAR1TAAR1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5607953-A | ANTIISCHEMIC AGENTS | EISAI CO., LTD. (JP) | 1997-03-04 | — | — | US | disclosed |
| EP-0344577-B1 | Butenoic or propenoic acid derivatives | EISAI CO LTD (JP) | 1996-10-09 | — | — | EP | disclosed |
| US-5382595-A | Antiischemic agents | EISAI CO., LTD. (JP) | 1995-01-17 | — | — | US | disclosed |
| US-5177089-A | Antiischemic agent, vasodilator | EISAI CO., LTD. (JP) | 1993-01-05 | — | — | US | disclosed |
| US-5047417-A | Butenoic or propenoic acid derivatives | EISAI CO. LTD. (JP) | 1991-09-10 | — | — | US | disclosed |
| CN-1040366-A | Butenoic acid or acrylic acid derivative | EISAI CO LTD (JP) | 1990-03-14 | — | — | CN | disclosed |
| EP-0344577-A2 | Butenoic or propenoic acid derivatives | Eisai Co., Ltd. (JP) | 1989-12-06 | — | — | EP | disclosed |