Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | PDE2A | O00408 | 1/20 | 0.43 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9214611 | 0.88 | PTGER2 (0.48) | KDM4ECHRM2CHRM1CHRM3GFER | |
| SCHEMBL9217159 | 0.81 | ACHE (0.44) | CHRNB2CHRNA4CACNA1IKDM4EPDE2A | |
| Hydrochloric Acid SCHEMBL9206800 | 0.79 | DRD2 (0.41) | CHRNB2CHRNA4CACNA1IKDM4EALDH1A1 | |
| SCHEMBL9206955 | 0.77 | DRD2 (0.44) | CHRNB2CHRNA4CACNA1IKDM4EPDE2A | |
| SCHEMBL803678 | 0.77 | CHRNB2 (0.54) | CHRNB2CHRNA4CACNA1IKDM4ETRPV6 | |
| SCHEMBL23291216 | 0.76 | CHRNB2 (0.56) | CHRNB2CHRNA4CACNA1IKDM4ETRPV6 | |
| SCHEMBL9211536 | 0.76 | CHRNB2 (0.56) | CHRNB2CHRNA4CACNA1IKDM4ETRPV6 | |
| SCHEMBL23291215 | 0.76 | CHRNB2 (0.56) | CHRNB2CHRNA4CACNA1IKDM4ETRPV6 | |
| SCHEMBL9216662 | 0.75 | HRH3 (0.43) | — | |
| Hydrochloric Acid SCHEMBL9216765 | 0.75 | HRH3 (0.41) | CHRM2CHRM1CHRM3KMT2A |
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-0292840-B1 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | THOMAE GMBH DR K (DE) | 1995-08-09 | — | — | EP | disclosed |
| US-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |
| EP-0292840-A2 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-11-30 | — | — | EP | disclosed |