Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7630095 | 0.94 | ALDH1A1 (0.32) | TSHROPRM1ALDH1A1 | |
| SCHEMBL7629395 | 0.90 | CNR1 (0.33) | CNR1TSHROPRM1ALDH1A1CNR2 | |
| SCHEMBL6958648 | 0.85 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL7624527 | 0.83 | TSHR (0.31) | TSHRALDH1A1 | |
| SCHEMBL126481 | 0.81 | ADRB2 (0.32) | OPRM1 | |
| SCHEMBL198357 | 0.80 | TSHR (0.40) | CNR1TSHRALDH1A1CNR2LPAR3 | |
| SCHEMBL127726 | 0.80 | TSHR (0.40) | TSHRLPAR3 | |
| SCHEMBL127317 | 0.80 | TSHR (0.40) | TSHRLPAR3 | |
| SCHEMBL2152601 | 0.78 | TSHR (0.41) | TSHR | |
| SCHEMBL818098 | 0.78 | TSHR (0.44) | TSHRLPAR3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6448247-B1 | TACHYKININ RECEPTOR ANTAGONIST; ESPECIALLY TO THE RECEPTORS FOR SUBSTANCE P (WHICH RECEPTORS ARE GENERALLY REFERRED TO AS ?NEUROKININ 1 RECEPTORS?) | SANKYO COMPANY, LIMITED (JP) | 2002-09-10 | — | — | US | disclosed |
| US-6159967-A | Heterocyclic compounds having tachykinin receptor antagonist activity their preparation and their use | SANKYO COMPANY, LIMITED (JP) | 2000-12-12 | — | — | US | disclosed |
| CN-1157286-A | N,N-dimethyl-1-t-butoxycarbonyl-4-phenylpiperidine-4-carboxamide | SANKYO CO (JP) | 1997-08-20 | — | — | CN | disclosed |
| EP-0776893-A1 | Azaheterocyclic compounds having tachykinin receptor antagonist activity; Nk1 and NK2 | SANKYO COMPANY LIMITED (JP) | 1997-06-04 | — | — | EP | disclosed |