Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.35 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7417670 | 0.91 | HTR1A (0.34) | DRD2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL7425334 | 0.76 | AKR1C3 (0.37) | ALDH1A1KDM4EHPGDHSD17B10KMT2A | |
| SCHEMBL7325790 | 0.73 | ALDH1A1 (0.43) | ALDH1A1ALOX15KDM4EHPGDHSD17B10 | |
| SCHEMBL7326938 | 0.72 | NR4A1 (0.36) | ALDH1A1ALOX15KDM4EHPGDHSD17B10 | |
| SCHEMBL25509092 | 0.71 | TRPV1 (0.42) | ALDH1A1KMT2A | |
| SCHEMBL7332416 | 0.71 | ALDH1A1 (0.38) | ALDH1A1ALOX15KDM4EHPGDHSD17B10 | |
| SCHEMBL7426602 | 0.70 | ALDH1A1 (0.40) | ALDH1A1ALOX15KDM4EHPGDHSD17B10 | |
| SCHEMBL2816001 | 0.69 | ACHE (0.50) | ALDH1A1ALOX15 | |
| SCHEMBL2817625 | 0.69 | ACHE (0.50) | ALDH1A1ALOX15 | |
| SCHEMBL6095257 | 0.69 | ACHE (0.50) | ALDH1A1ALOX15 |
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-6127379-A | TREATING IRRITABLE BOWEL SYNDROME, URINARY INCONTINENCE, ATRIAL ARRHYTHMIA OR STROKE | SMITHKLINE BEECHAM P.L.C. (GB) | 2000-10-03 | — | — | US | disclosed |
| EP-0625149-A1 | BENZOPYRAN, BENZOTHIOPYRAN AND BENZOFURAN DERIVATIVES AS 5-HT4 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-11-23 | — | — | EP | disclosed |
| WO-1993016072-A1 | BENZOPYRAN, BENZOTHIOPYRAN AND BENZOFURAN DERIVATIVES AS 5-HT4 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-08-19 | — | — | WO | disclosed |