Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ANO1 | Q5XXA6 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ANO2 | Q9NQ90 | 1/20 | 0.42 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
| ▸ | OXTR | P30559 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8282048 | 0.86 | S1PR1 (0.50) | S1PR1MEN1KMT2AANO1RAB9A | |
| SCHEMBL23349276 | 0.68 | S1PR1 (0.56) | S1PR1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL19356293 | 0.68 | S1PR1 (0.52) | S1PR1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL8280935 | 0.67 | MAPT (0.48) | MEN1KMT2ARAB9ANPC1KDM4E | |
| SCHEMBL8280967 | 0.66 | KMT2A (0.53) | S1PR1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL24349545 | 0.65 | ANO1 (0.68) | MEN1KMT2AANO1RAB9ANPC1 | |
| SCHEMBL14327840 | 0.65 | S1PR1 (0.80) | S1PR1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL24348525 | 0.65 | ANO1 (0.67) | MEN1KMT2AANO1RAB9ANPC1 | |
| SCHEMBL1413284 | 0.64 | S1PR1 (1.00) | S1PR1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL24524660 | 0.64 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005082866-A2 | SUBSTITUTED 1, 2, 4- TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS | PFIZER LIMITED (GB) | 2005-09-09 | — | — | WO | disclosed |