Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.50 |
| ▸ | RXRB | P28702 | 1/20 | 0.50 |
| ▸ | RXRG | P48443 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | PTGER1 | P34995 | 10/20 | 0.44 |
| ▸ | PTGER4 | P35408 | 7/20 | 0.44 |
| ▸ | PTGER3 | P43115 | 7/20 | 0.44 |
| ▸ | PTGER2 | P43116 | 7/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD5 | P21918 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | PTGFR | P43088 | 1/20 | 0.43 |
| ▸ | PTGIR | P43119 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 2/20 | 0.41 |
| ▸ | ERN1 | O75460 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15602818 | 0.91 | RXRA (0.43) | RXRARXRBRXRGHTR2BMCL1 | |
| SCHEMBL4556877 | 0.76 | RXRA (0.51) | RXRARXRBRXRGMCL1PTGER1 | |
| SCHEMBL30608416 | 0.76 | HTR2B (0.76) | HTR2B | |
| SCHEMBL1534272 | 0.76 | HTR2B (0.76) | HTR2B | |
| SCHEMBL1686982 | 0.76 | HTR2B (0.76) | HTR2B | |
| SCHEMBL7723380 | 0.75 | RXRA (0.50) | RXRARXRBRXRGMCL1PTGER1 | |
| SCHEMBL7724707 | 0.75 | RXRA (0.50) | RXRARXRBRXRGMCL1PTGER1 | |
| SCHEMBL5999284 | 0.74 | HTR2B (0.54) | HTR2B | |
| SCHEMBL1268161 | 0.73 | HTR2B (0.47) | HTR2BERN1 | |
| SCHEMBL15602761 | 0.73 | ALDH1A1 (0.47) | HTR2B |
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 |
|---|---|---|---|---|---|---|---|
| US-6403623-B1 | ADMINISTERING 2-(2-SUBSTITUTED-PHENYL)-2-OXAZOLINES AND RELATED 5-MEMBERED HETEROCYCLES | UNUVERSITY OF NOTRE DAME DU LAC | 2002-06-11 | — | — | US | claimed |
| US-6403623-B1 | ADMINISTERING 2-(2-SUBSTITUTED-PHENYL)-2-OXAZOLINES AND RELATED 5-MEMBERED HETEROCYCLES | UNUVERSITY OF NOTRE DAME DU LAC | 2002-06-11 | — | — | US | disclosed |
| US-6310058-B1 | N-HYDROXYAZEPIN-2-ONES SUBSTITUTED AT 3 POSITION WITH A GROUP CONTAINING A 2-PHENYLOXAZOLE OR 2-PHENYLOXAZOLINE GROUP FOR TREATING TUBERCULOSIS | UNIVERSITY OF NOTRE DAME DU LAC | 2001-10-30 | — | — | US | disclosed |