Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 10/20 | 0.68 |
| ▸ | AVPR1A | P37288 | 15/20 | 0.66 |
| ▸ | AVPR2 | P30518 | 11/20 | 0.63 |
| ▸ | AVPR1B | P47901 | 7/20 | 0.62 |
| ▸ | TACR1 | P25103 | 1/20 | 0.62 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.62 |
| ▸ | GHSR | Q92847 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL4124946 | 0.89 | AVPR1A (0.66) | OXTRAVPR1AAVPR2AVPR1BTACR1 | |
| SCHEMBL4112837 | 0.83 | AVPR1A (0.65) | OXTRAVPR1AAVPR2AVPR1BTACR1 | |
| SCHEMBL8271860 | 0.83 | AVPR1A (0.67) | OXTRAVPR1AAVPR2AVPR1BTACR1 | |
| SCHEMBL4125784 | 0.83 | AVPR1A (0.67) | OXTRAVPR1AAVPR2AVPR1BTACR1 | |
| SCHEMBL4111772 | 0.82 | AVPR1A (0.68) | OXTRAVPR1AAVPR2AVPR1BTACR1 | |
| SCHEMBL4132742 | 0.79 | AVPR1A (0.76) | OXTRAVPR1AAVPR2AVPR1BTACR1 | |
| SCHEMBL4118198 | 0.79 | OXTR (0.72) | OXTRAVPR1AAVPR2AVPR1BTACR1 | |
| SCHEMBL4118667 | 0.78 | OXTR (0.68) | OXTRAVPR1AAVPR2AVPR1BTACR1 | |
| SCHEMBL20327957 | 0.78 | AVPR1A (1.00) | OXTRAVPR1AAVPR2AVPR1BTACR1 | |
| SCHEMBL20327922 | 0.77 | AVPR1A (0.75) | OXTRAVPR1AAVPR2AVPR1BTACR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3564231-A1 | AZABICYCLO-SUBSTITUTED TRIAZOLE DERIVATIVE, PREPARATION METHOD THEREOF, AND APPLICATION OF SAME IN MEDICINE | Jiangsu Hengrui Medicine Co., Ltd. (CN) | 2019-11-06 | — | — | EP | disclosed |
| WO-2018121551-A1 | AZABICYCLO-SUBSTITUTED TRIAZOLE DERIVATIVE, PREPARATION METHOD THEREOF, AND APPLICATION OF SAME IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2018-07-05 | — | — | WO | disclosed |