Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | DRD4 | P21917 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL81121 | 0.79 | MTNR1A (0.57) | KMT2AMEN1TAS1R3TAS1R1TDP1 | |
| SCHEMBL15577014 | 0.79 | DRD2 (0.49) | DRD2DRD3HTR1A | |
| SCHEMBL266635 | 0.78 | DRD2 (0.50) | ACHEDRD2DRD3HTR1A | |
| SCHEMBL55493 | 0.77 | ALDH1A1 (0.60) | KMT2AMEN1TAS1R3TAS1R1TDP1 | |
| SCHEMBL28446992 | 0.77 | PARP1 (0.46) | ACHEKMT2AMEN1 | |
| SCHEMBL9731367 | 0.76 | ALDH1A1 (0.60) | KMT2AMEN1TAS1R3TAS1R1TDP1 | |
| SCHEMBL10192239 | 0.75 | DRD2 (0.43) | DRD2DRD3TDP1HTR1A | |
| SCHEMBL20478729 | 0.75 | HCRTR1 (0.44) | DRD2KMT2AMEN1TAS1R3TAS1R1 | |
| SCHEMBL10246358 | 0.75 | DRD2 (0.49) | DRD2HTR1A | |
| SCHEMBL769658 | 0.74 | DRD2 (0.42) | DRD2KMT2AMEN1TAS1R3TAS1R1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0687257-A1 | 4-AMINO-2-(HETERO)ARYL-BUTANAMIDES USEFUL AS 5-HT1A-ANTAGONISTS | WYETH JOHN & BROTHER LTD (GB) | 1995-12-20 | — | — | EP | disclosed |
| WO-1994020481-A1 | 4-AMINO-2-(HETERO)ARYL-BUTANAMIDES USEFUL AS 5-HT1A-ANTAGONISTS | JOHN WYETH & BROTHER LIMITED (GB) | 1994-09-15 | — | — | WO | disclosed |