Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP3 | P05413 | 3/20 | 0.38 |
| ▸ | FABP4 | P15090 | 10/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL5765711 | 0.82 | PARP1 (0.36) | PARP1 | |
| SCHEMBL25432221 | 0.75 | KDM4E (0.52) | KDM4EALDH1A1POLBHSP90AA1RXFP1 | |
| SCHEMBL30542823 | 0.75 | KDM4E (0.52) | KDM4EALDH1A1POLBHSP90AA1RXFP1 | |
| SCHEMBL1395799 | 0.75 | HTR2A (0.52) | KDM4EALDH1A1HPGDHSD17B10LMNA | |
| SCHEMBL9145502 | 0.73 | CSNK2A2 (0.40) | FABP4KDM4EALDH1A1POLBHSP90AA1 | |
| SCHEMBL2261530 | 0.71 | HTR2A (0.48) | FABP3FABP4 | |
| SCHEMBL10903433 | 0.70 | CHRM1 (0.39) | FABP3FABP4KDM4EALDH1A1POLB | |
| SCHEMBL10905876 | 0.69 | HSD17B10 (0.40) | KDM4EALDH1A1POLBHSP90AA1RXFP1 | |
| SCHEMBL21465443 | 0.69 | CYP1A2 (0.44) | FABP3FABP4CYP3A4ALDH1A1LMNA | |
| SCHEMBL5754704 | 0.69 | CYP1A2 (0.44) | FABP3FABP4CYP3A4LMNAPARP1 |
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-5198437-A | 5-hydroxytryptamine antagonist | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1993-03-30 | — | — | US | disclosed |
| US-4985420-A | 5-HYDROXYTRYPTAMINE RECEPTOR ANTAGONISTS | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1991-01-15 | — | — | US | disclosed |
| EP-0322016-A1 | 1,7-Annelated indolecarboxylic acid esters and -amides | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1989-06-28 | — | — | EP | disclosed |