Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | NPC1 | O15118 | 6/20 | 0.60 |
| ▸ | RAB9A | P51151 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.60 |
| ▸ | CASP3 | P42574 | 3/20 | 0.60 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.60 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | SCD | O00767 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL38660966 | 0.93 | MEN1 (0.60) | KDM4EALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1123418 | 0.88 | NR1H4 (0.65) | KDM4EALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1123501 | 0.86 | L3MBTL1 (0.63) | KDM4EALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1123502 | 0.86 | SMN1; SMN2 (0.61) | KDM4EALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8709106 | 0.85 | NR1H4 (0.74) | ALDH1A1NPC1RAB9ASMN1; SMN2CASP3 | |
| SCHEMBL6542333 | 0.84 | KDM4E (0.57) | KDM4EALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL38659760 | 0.83 | MEN1 (0.62) | KDM4EALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1123090 | 0.83 | NR4A2 (0.65) | NPC1RAB9ASMN1; SMN2CASP3SENP7 | |
| SCHEMBL1123323 | 0.82 | PLK1 (0.64) | KDM4ENPC1RAB9ASMN1; SMN2CASP3 | |
| SCHEMBL5223929 | 0.82 | ALDH1A1 (0.68) | KDM4EALDH1A1CYP1A2CYP2C9CYP2C19 |
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-1644321-B1 | NEW BENZAMIDES AS PPATY MODULATORS | S A L V A T LAB SA (ES) | 2011-02-09 | — | — | EP | claimed |