Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.36 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.35 |
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 SCHEMBL9740467 | 0.99 | NAMPT (0.38) | NAMPTHRH3CCR2KCNH2CHRM2 | |
| SCHEMBL9209351 | 0.91 | CHRNB4 (0.46) | KCNH2CHRM2CHRNB4CHRNA3CHRNB2 | |
| Hydrochloric Acid SCHEMBL9740808 | 0.90 | CHRNB4 (0.45) | KCNH2CHRM2CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL9214452 | 0.90 | GRM5 (0.40) | HRH3CCR2KCNH2CHRM2CHRM1 | |
| SCHEMBL9216543 | 0.89 | LTA4H (0.39) | NAMPTHRH3CCR2KCNH2CHRNB4 | |
| SCHEMBL9214021 | 0.89 | CHRNB4 (0.43) | KCNH2CHRM2CHRNB4CHRNA3CHRNB2 | |
| Hydrochloric Acid SCHEMBL9214335 | 0.88 | GRM5 (0.39) | HRH3CCR2KCNH2CHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL9739565 | 0.88 | LTA4H (0.38) | NAMPTHRH3CCR2KCNH2CHRNB4 | |
| Hydrochloric Acid SCHEMBL9740211 | 0.88 | HRH3 (0.43) | HRH3CCR2KCNH2CHRM2CHRM1 | |
| SCHEMBL9215804 | 0.87 | GRM5 (0.39) | HRH3CCR2KCNH2CHRNB4CHRNA3 |
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 |