Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | MITF | O75030 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | P4HB | P07237 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9764451 | 0.83 | SMN1; SMN2 (0.45) | NPC1SMN1; SMN2KDM4EMITFGAA | |
| SCHEMBL9318691 | 0.80 | SLC2A1 (0.48) | KDM4EBCHEMAOACHRM2 | |
| SCHEMBL9764480 | 0.79 | MMP2 (0.43) | KDM4EMITFGAABCHEMAOA | |
| SCHEMBL9763710 | 0.78 | SIGMAR1 (0.43) | DRD4NPC1RAB9ASMN1; SMN2MAOA | |
| SCHEMBL9763494 | 0.78 | DRD2 (0.47) | DRD4NPC1RAB9ASMN1; SMN2BCHE | |
| SCHEMBL10417690 | 0.76 | MAOA (0.48) | DRD4KDM4EBCHEMAOAMAPK1 | |
| SCHEMBL9764455 | 0.76 | MAOA (0.40) | DRD4KDM4EMITFGAABCHE | |
| SCHEMBL9764397 | 0.74 | ACACB (0.43) | RAB9ASMN1; SMN2GAAMAPK1LMNA | |
| SCHEMBL9764499 | 0.74 | KDM4E (0.45) | KDM4EMITFGAABCHEMAOA | |
| SCHEMBL10952736 | 0.73 | MAOA (0.77) | DRD4GAABCHEMAOACHRM2 |
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-4990505-A | Treating asthma, bronchitis; adrenergic stimulants | GLAXO GROUP LIMITED (GB) | 1991-02-05 | — | — | US | disclosed |