Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KCNB1 | Q14721 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.31 |
| ▸ | TUBB | P07437 | 1/20 | 0.31 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.31 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.31 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.31 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.31 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.31 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5997132 | 0.98 | ALDH1A1 (0.44) | ALDH1A1CYP2C19CYP3A4HPGDKCNB1 | |
| SCHEMBL27556007 | 0.83 | TAS1R3 (0.40) | ALDH1A1CYP2C19HPGDKCNB1KDM4E | |
| SCHEMBL5995537 | 0.82 | ALDH1A1 (0.40) | ALDH1A1CYP2C19CYP3A4HPGDKCNB1 | |
| SCHEMBL27614672 | 0.81 | ALDH1A1 (0.42) | ALDH1A1CYP2C19HPGDKDM4EKMT2A | |
| SCHEMBL5997368 | 0.81 | TAS1R3 (0.40) | ALDH1A1CYP2C19CYP3A4HPGDKCNB1 | |
| SCHEMBL5995316 | 0.79 | ALDH1A1 (0.44) | ALDH1A1CYP2C19HPGDKDM4EKMT2A | |
| SCHEMBL27505875 | 0.76 | TSHR (0.44) | ALDH1A1HPGDL3MBTL1SMN1; SMN2 | |
| SCHEMBL27507510 | 0.76 | ALDH1A1 (0.40) | ALDH1A1CYP3A4GAASMN1; SMN2 | |
| SCHEMBL5996567 | 0.76 | PGK1 (0.31) | CYP3A4SMN1; SMN2TDP1 | |
| SCHEMBL5995424 | 0.76 | ALDH1A1 (0.40) | ALDH1A1CYP2C19CYP3A4HPGDKCNB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1198831-C | Organic metal monoacylalkylphosphine compound | CIBA SC HOLDING AG (CH) | 2005-04-27 | — | — | CN | disclosed |
| CN-1329005-A | Organic metal monoacylalkylphosphine compound | CIBA SC HOLDING AG (CH) | 2002-01-02 | — | — | CN | disclosed |