Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR4 | P31391 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL3554824 | 0.83 | CHRM3 (0.44) | KEAP1NFE2L2CHRM3MAPTCYP3A4 | |
| SCHEMBL2646811 | 0.80 | SLC6A3 (0.41) | SSTR4SLC6A3TAS1R3TAS1R2LMNA | |
| SCHEMBL27770442 | 0.78 | CHRM3 (0.45) | KEAP1NFE2L2SLC6A3CHRM3TSHR | |
| SCHEMBL4213705 | 0.77 | KEAP1 (0.61) | KEAP1NFE2L2CHRM3CYP2C9CHRM2 | |
| SCHEMBL4203042 | 0.77 | KEAP1 (0.61) | KEAP1NFE2L2CHRM3CYP2C9CHRM2 | |
| SCHEMBL4203592 | 0.77 | KEAP1 (0.61) | KEAP1NFE2L2CHRM3CYP2C9CHRM2 | |
| SCHEMBL9899047 | 0.76 | CHRM3 (0.44) | KEAP1NFE2L2CHRM3CYP3A4CYP2C9 | |
| SCHEMBL4247916 | 0.76 | KEAP1 (0.47) | KEAP1NFE2L2CHRM3CHRM2CHRM4 | |
| SCHEMBL7550366 | 0.76 | MEN1 (0.44) | CHRM3TSHRMAPTCYP3A4CYP2C9 | |
| SCHEMBL2788610 | 0.76 | KEAP1 (0.59) | KEAP1NFE2L2CHRM3CHRM2CHRM4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2649045-B1 | SUBSTITUTED 1-BENZYLCYCLOALKYLCARBOXLIC ACIDS AND USE THEREOF | BAYER IP GMBH (DE) | 2015-05-27 | — | — | EP | disclosed |
| EP-2649045-A2 | SUBSTITUTED 1-BENZYLCYCLOALKYLCARBOXLIC ACIDS AND USE THEREOF | Bayer Intellectual Property GmbH (DE) | 2013-10-16 | — | — | EP | disclosed |
| WO-2012076466-A2 | SUBSTITUTED 1-BENZYLCYCLOALKYLCARBOXLIC ACIDS AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-06-14 | — | — | WO | disclosed |