Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 9/20 | 0.71 |
| ▸ | AVPR1A | P37288 | 7/20 | 0.54 |
| ▸ | AVPR2 | P30518 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | UCHL3 | P15374 | 1/20 | 0.40 |
| ▸ | GRK6 | P43250 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL8279809 | 0.90 | OXTR (0.68) | OXTRAVPR1AAVPR2HPGDSMN1; SMN2 | |
| SCHEMBL8281669 | 0.86 | OXTR (0.77) | OXTRAVPR1AAVPR2HPGDSMN1; SMN2 | |
| SCHEMBL8282112 | 0.83 | OXTR (1.00) | OXTRAVPR1AAVPR2 | |
| SCHEMBL8282111 | 0.82 | OXTR (0.61) | OXTRAVPR1AAVPR2HPGDSMN1; SMN2 | |
| SCHEMBL8280928 | 0.79 | OXTR (0.58) | OXTRAVPR1AAVPR2HPGDSMN1; SMN2 | |
| SCHEMBL8281723 | 0.79 | OXTR (0.58) | OXTRAVPR1AAVPR2MAPTNPSR1 | |
| SCHEMBL6511017 | 0.72 | OXTR (0.80) | OXTRAVPR1AAVPR2 | |
| SCHEMBL27530845 | 0.70 | SMN1; SMN2 (0.79) | OXTRAVPR1AAVPR2HPGDSMN1; SMN2 | |
| SCHEMBL8282084 | 0.70 | OXTR (0.81) | OXTRAVPR1AAVPR2 | |
| SCHEMBL8281027 | 0.69 | OXTR (1.00) | OXTRAVPR1AAVPR2 |
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 |