Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8875107 | 0.85 | SIGMAR1 (0.42) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL8893688 | 0.84 | SIGMAR1 (0.43) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL9281012 | 0.84 | SIGMAR1 (0.43) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL8543227 | 0.84 | SIGMAR1 (0.43) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL8956750 | 0.84 | SIGMAR1 (0.43) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| Hydrochloric Acid SCHEMBL8895671 | 0.83 | SIGMAR1 (0.42) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL8874651 | 0.79 | SIGMAR1 (0.46) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| Hydrochloric Acid SCHEMBL8874914 | 0.76 | SIGMAR1 (0.49) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5809783 | 0.76 | SIGMAR1 (0.54) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL8875798 | 0.75 | CHRM4 (0.41) | SIGMAR1CHRM4KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5624950-A | USEFUL IN TREATMENT OF ANALGESIA, INFLAMMATION, ASTHMA, ALLERGIES, CENTRAL NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS, IMMUNE SYSTEM DISORDERS, ANTISPASMODIC AGENTS, ANTIEMETIC AGENTS | RHONE-POULENC RORER S.A. (FR) | 1997-04-29 | — | — | US | disclosed |