Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 5/20 | 0.45 |
| ▸ | CCR6 | P51684 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 7/20 | 0.42 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
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 SCHEMBL2879216 | 0.87 | EPHX1 (0.48) | EPHX2CCR6KCNH2EPHX1TRPV1 | |
| SCHEMBL9899047 | 0.83 | CHRM3 (0.44) | CHRM3CHRM2CHRM4CHRM1 | |
| SCHEMBL27770442 | 0.79 | CHRM3 (0.45) | CHRM3ALDH1A1HPGDCHRM2CHRM4 | |
| SCHEMBL4213705 | 0.78 | KEAP1 (0.61) | CHRM3ALDH1A1CHRM2CHRM4CHRM1 | |
| SCHEMBL4203592 | 0.78 | KEAP1 (0.61) | CHRM3ALDH1A1CHRM2CHRM4CHRM1 | |
| SCHEMBL4203042 | 0.78 | KEAP1 (0.61) | CHRM3ALDH1A1CHRM2CHRM4CHRM1 | |
| SCHEMBL3554824 | 0.77 | CHRM3 (0.44) | CHRM3POLBCHRM2CHRM4CHRM1 | |
| SCHEMBL2788610 | 0.77 | KEAP1 (0.59) | KCNH2CHRM3POLBCHRM2CHRM4 | |
| SCHEMBL17261138 | 0.75 | TRPV1 (0.53) | EPHX2CCR6KCNH2TRPV1NR1H4 | |
| SCHEMBL14587261 | 0.75 | KEAP1 (0.56) | L3MBTL1CHRM3ALDH1A1CHRM2CHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2649045-B1 | SUBSTITUTED 1-BENZYLCYCLOALKYLCARBOXLIC ACIDS AND USE THEREOF | BAYER IP GMBH (DE) | 2015-05-27 | — | — | EP | disclosed |