Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.44 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9434050 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD | |
| SCHEMBL10902247 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD | |
| SCHEMBL10543217 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD | |
| SCHEMBL9434472 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD | |
| SCHEMBL10902234 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD | |
| SCHEMBL10898563 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD | |
| SCHEMBL9433613 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD | |
| SCHEMBL10925831 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD | |
| SCHEMBL9434488 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD | |
| SCHEMBL9434037 | 1.00 | HCAR2 (0.56) | HCAR2ATMTSHRNAAAHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5276150-A | Vasodilators, anticoagulants, calcium channel blockers | FUJIREBIO INC. (JP) | 1994-01-04 | — | — | US | disclosed |
| EP-0400660-A1 | 1,4-dihydropyridine derivatives | FUJIREBIO INC. (JP) | 1990-12-05 | — | — | EP | disclosed |