Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 2/20 | 0.53 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.43 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.41 |
| ▸ | ESR1 | P03372 | 3/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL11209313 | 0.85 | CYP11B1 (0.56) | CYP11B1CYP11B2PTGS2MMP3BCL2L1 | |
| SCHEMBL8058170 | 0.84 | CYP11B2 (0.61) | CYP11B1CYP11B2PTGS2IP6K1IP6K3 | |
| SCHEMBL6285180 | 0.84 | CYP11B2 (0.61) | CYP11B1CYP11B2PTGS2IP6K1IP6K3 | |
| SCHEMBL319265 | 0.84 | CYP11B2 (0.65) | CYP11B1CYP11B2PTGS2IP6K1IP6K3 | |
| SCHEMBL31608568 | 0.84 | CYP11B2 (0.65) | CYP11B1CYP11B2PTGS2IP6K1IP6K3 | |
| SCHEMBL6287169 | 0.82 | CYP11B1 (0.54) | CYP11B1CYP11B2PTGS2IP6K1IP6K3 | |
| SCHEMBL30487694 | 0.82 | CYP11B1 (0.54) | CYP11B1CYP11B2PTGS2IP6K1IP6K3 | |
| SCHEMBL31666281 | 0.82 | CYP11B2 (0.62) | CYP11B1CYP11B2PTGS2IP6K1IP6K3 | |
| SCHEMBL22568909 | 0.81 | CYP11B1 (0.45) | CYP11B1CYP11B2PTGS2MMP3BCL2L1 | |
| SCHEMBL19432718 | 0.81 | MMP3 (0.48) | CYP11B1CYP11B2MMP3BCL2L1ESR2 |
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-105849096-B | Piperidine derivatives having multimodal activity against pain | 埃斯蒂文制药股份有限公司 | 2019-11-29 | — | — | CN | disclosed |
| CN-104066730-B | Heterocyclic compounds and their use as type III receptor tyrosine kinase modulators | 埃姆比特生物科学公司 | 2017-03-08 | — | — | CN | disclosed |