Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 7/20 | 0.41 |
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8282045 | 0.83 | S1PR1 (0.38) | MAPTKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8281995 | 0.83 | MAPT (0.64) | MAPTKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8280939 | 0.83 | MAPT (0.50) | MAPTKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8281642 | 0.83 | MAPT (0.50) | MAPTKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8280935 | 0.81 | MAPT (0.48) | MAPTKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8282545 | 0.80 | MAPT (0.47) | MAPTKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL5127949 | 0.72 | PTK2 (0.56) | MAPTKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8279831 | 0.68 | GLA (0.48) | KDM4EALDH1A1POLBTSHRLMNA | |
| SCHEMBL8282607 | 0.68 | GLA (0.48) | KDM4EALDH1A1POLBTSHRLMNA | |
| SCHEMBL2088807 | 0.68 | MAPT (0.69) | MAPTKDM4EALDH1A1HPGDPOLB |
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 |