Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 8/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 8/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.37 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.37 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.37 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.37 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.37 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.37 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28007658 | 0.99 | HCAR2 (0.39) | HCAR2MTNR1AMTNR1BNPC1PRKAB2 | |
| SCHEMBL28007337 | 0.85 | GABRG2 (0.43) | MTNR1AMTNR1BNPC1 | |
| SCHEMBL16610221 | 0.79 | MTNR1B (0.38) | MTNR1AMTNR1BKMT2AMEN1SLC6A4 | |
| SCHEMBL4915074 | 0.73 | GABRA1 (0.46) | NPC1CYP1A2CYP3A4CYP2D6KDM4E | |
| SCHEMBL28819880 | 0.72 | GABRA1 (0.46) | MTNR1AMTNR1BNPC1CYP1A2CYP3A4 | |
| SCHEMBL1046830 | 0.71 | MTNR1B (0.45) | MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL18080758 | 0.70 | MTNR1B (0.39) | MTNR1AMTNR1BNPC1CYP1A2CYP2D6 | |
| SCHEMBL1050599 | 0.69 | MTNR1A (0.43) | MTNR1AMTNR1BCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL19555767 | 0.68 | HCAR2 (0.42) | HCAR2CYP1A2CYP3A4KMT2AKDM4E | |
| SCHEMBL30112008 | 0.68 | HCAR2 (0.42) | HCAR2CYP1A2CYP3A4KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-104640847-B | Novel Renin Inhibitors | 上海医药集团股份有限公司 | 2019-10-15 | — | — | CN | disclosed |
| CN-104640847-A | Novel Renin Inhibitors | SHANGHAI PHARMACEUTICALS HOLDING CO LTD | 2015-05-20 | — | — | CN | disclosed |