Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 7/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TGFBR1 | P36897 | 5/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MMEL1 | Q495T6 | 1/20 | 0.40 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.39 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C8 | P10632 | 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 | |
|---|---|---|---|---|
| SCHEMBL13062796 | 0.86 | CYP11B1 (0.44) | GRM2CYP11B1CYP11B2NPC1RAB9A | |
| SCHEMBL15060601 | 0.79 | CYP11B1 (0.59) | GRM2CYP11B1CYP11B2NPC1RAB9A | |
| SCHEMBL9327112 | 0.79 | CYP11B1 (0.46) | GRM2CYP2C9CYP11B1CYP11B2NPC1 | |
| SCHEMBL2056331 | 0.77 | GRM2 (0.55) | GRM2CYP11B1CYP11B2NPC1RAB9A | |
| SCHEMBL15060624 | 0.77 | GRM2 (0.43) | GRM2CYP2C9CYP11B1CYP11B2NPC1 | |
| SCHEMBL15060602 | 0.76 | GRM2 (0.47) | GRM2CYP2C9CYP11B1CYP11B2NPC1 | |
| SCHEMBL9325737 | 0.75 | NPC1 (0.52) | GRM2CYP2C9CYP11B1CYP11B2NPC1 | |
| SCHEMBL28115668 | 0.75 | TGFBR1 (0.51) | TGFBR1CYP1A2ACVR1BACVRL1CYP3A4 | |
| SCHEMBL12603839 | 0.75 | SMN1; SMN2 (0.61) | GRM2NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL8174949 | 0.74 | RAB9A (0.58) | GRM2CYP2C9CYP11B1CYP11B2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106132950-A | Compounds and methods of use | 麦迪韦逊技术股份有限公司 | 2016-11-16 | — | — | CN | disclosed |