Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 5/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7308557 | 0.89 | CHRM3 (0.44) | FKBP1ACHRM3CHRM2CHRM4CHRM1 | |
| SCHEMBL7308546 | 0.89 | CHRM3 (0.44) | FKBP1ACHRM3CHRM2CHRM4CHRM1 | |
| SCHEMBL7306123 | 0.87 | CFD (0.47) | FKBP1ACYP3A4CYP2C9PKMCYP2C19 | |
| SCHEMBL7309175 | 0.84 | F2 (0.54) | FKBP1ACYP3A4CYP2C9PKMCYP2C19 | |
| SCHEMBL7316569 | 0.82 | PRCP (0.45) | FKBP1ACHRM3L3MBTL1CHRM2CHRM4 | |
| SCHEMBL7309077 | 0.81 | CACNA1B (0.40) | FKBP1ACHRM3 | |
| SCHEMBL7307445 | 0.81 | CACNA1B (0.40) | FKBP1ACHRM3 | |
| SCHEMBL7305475 | 0.81 | FKBP1A (0.53) | FKBP1AEPHX2 | |
| SCHEMBL7305485 | 0.81 | FKBP1A (0.53) | FKBP1AEPHX2 | |
| SCHEMBL7309531 | 0.80 | FKBP1A (0.51) | FKBP1A |
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-0805147-A1 | Novel N-substituted alpha aminoacid amides as calcium channel modulators | LILLY INDUSTRIES LIMITED (GB) | 1997-11-05 | — | — | EP | disclosed |