Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FUCA1 | P04066 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 3/20 | 0.52 |
| ▸ | BCHE | P06276 | 2/20 | 0.51 |
| ▸ | BACE1 | P56817 | 2/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | CCR3 | P51677 | 1/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14157507 | 1.00 | FUCA1 (0.56) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL14157508 | 1.00 | FUCA1 (0.56) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL500532 | 1.00 | FUCA1 (0.56) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL14157505 | 1.00 | FUCA1 (0.56) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6503566 | 0.96 | FUCA1 (0.56) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6503563 | 0.96 | FUCA1 (0.56) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL18477518 | 0.94 | FUCA1 (0.55) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL11413096 | 0.92 | FUCA1 (0.60) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL694513 | 0.89 | FUCA1 (0.64) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6616536 | 0.89 | FUCA1 (0.50) | FUCA1CYP1A2CYP3A4CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2097400-B1 | FUSED SUBSTITUTED AMINOPYRROLIDINE DERIVATIVE | DAIICHI SANKYO CO LTD (JP) | 2013-07-03 | — | — | EP | disclosed |