Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | ACP3 | P15309 | 1/20 | 0.42 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.41 |
| ▸ | ADA | P00813 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | DNM1 | Q05193 | 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 | |
|---|---|---|---|---|
| SCHEMBL7277353 | 0.89 | MTNR1A (0.49) | MTNR1ATDP1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL8662663 | 0.87 | SIGMAR1 (0.41) | MTNR1ATDP1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL8535073 | 0.84 | CYP1A2 (0.50) | MTNR1ATDP1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL7278098 | 0.83 | TDP1 (0.47) | MTNR1ATDP1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL8539991 | 0.81 | CYP1A2 (0.47) | MTNR1ATDP1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL28702695 | 0.80 | SIGMAR1 (0.52) | MTNR1ATDP1ACP3CTNNB1 | |
| SCHEMBL2480671 | 0.79 | KMT2A (0.51) | MTNR1ATDP1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL20825094 | 0.79 | MTNR1A (0.50) | MTNR1ATDP1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL6684869 | 0.78 | CYP1A2 (0.48) | MTNR1ATDP1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL2692036 | 0.78 | MTNR1A (0.40) | MTNR1ATDP1CYP1A2CYP2C19CYP2C9 |
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 |