Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 6/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.44 |
| ▸ | TUBB | P07437 | 2/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.44 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL23349276 | 0.82 | S1PR1 (0.56) | KMT2AMEN1S1PR1HPGDKDM4E | |
| SCHEMBL19356293 | 0.79 | S1PR1 (0.52) | KMT2AMEN1S1PR1HPGDKDM4E | |
| SCHEMBL11884342 | 0.78 | NOTUM (0.60) | HPGDKDM4EALDH1A1HSD17B10RAB9A | |
| SCHEMBL17559462 | 0.77 | PRMT5 (0.55) | KMT2AMEN1S1PR1HPGDKDM4E | |
| SCHEMBL12057005 | 0.76 | S1PR1 (0.54) | S1PR1HPGDKDM4EALDH1A1HSD17B10 | |
| SCHEMBL8282012 | 0.75 | KDM4E (0.71) | KMT2AMEN1HPGDKDM4EALDH1A1 | |
| SCHEMBL17559379 | 0.75 | PRMT5 (0.53) | KMT2AMEN1S1PR1HPGDKDM4E | |
| SCHEMBL15599433 | 0.74 | LRRK2 (0.47) | HPGDKDM4EALDH1A1HSD17B10RAB9A | |
| SCHEMBL7805208 | 0.74 | SNCA (0.53) | HPGDLMNASMN1; SMN2LRRK2NOTUM | |
| SCHEMBL15507192 | 0.74 | ALDH1A1 (0.50) | HPGDKDM4EALDH1A1HSD17B10RAB9A |
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 |