Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1B | P35368 | 10/20 | 0.52 |
| ▸ | HTR1A | P08908 | 7/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.45 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10365727 | 0.87 | ADORA2B (0.55) | HTR1AADORA2BHTR4KDM4EALDH1A1 | |
| SCHEMBL10365600 | 0.83 | DRD4 (0.57) | HTR1ASIGMAR1ADORA2BHTR4LMNA | |
| SCHEMBL7282947 | 0.82 | ADORA2B (0.57) | HTR1AADORA2BHTR4MAPT | |
| SCHEMBL10365197 | 0.82 | NOTUM (0.42) | ADRA1BHTR1ASIGMAR1CYP1A2CYP2D6 | |
| SCHEMBL10365769 | 0.81 | DRD2 (0.61) | HTR1A | |
| SCHEMBL10365109 | 0.79 | MAPT (0.49) | SIGMAR1CYP1A2CYP2D6TSHRADORA2B | |
| SCHEMBL7290042 | 0.77 | DRD3 (0.48) | ADRA1BADRA1AADRA1DTSHRALDH1A1 | |
| SCHEMBL22882677 | 0.76 | MGAM (0.43) | SIGMAR1CYP1A2CYP2D6TSHRALDH1A1 | |
| Acaprazine SCHEMBL2110181 | 0.76 | DRD4 (0.65) | ADRA1BHTR1AADRA1ATP53MAPT | |
| SCHEMBL10368157 | 0.76 | ACACB (0.42) | SIGMAR1CYP1A2CYP2D6TSHRKDM4E |
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-0094159-B1 | DIHYDROPYRIDINE DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1990-03-14 | — | — | EP | disclosed |
| US-4892875-A | HYPOTENSIVE, RENAL VASODILATION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-01-09 | — | — | US | disclosed |
| EP-0094159-A1 | Dihydropyridine derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1983-11-16 | — | — | EP | disclosed |