Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.45 |
| ▸ | METAP1 | P53582 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | PDE5A | O76074 | 2/20 | 0.43 |
| ▸ | METAP2 | P50579 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | ITK | Q08881 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3380916 | 0.79 | HSD17B10 (0.65) | NUDT1KMT2AALDH1A1CYP2C9NOS1 | |
| SCHEMBL3967813 | 0.78 | NUDT1 (0.55) | NUDT1KMT2AHPSEMETAP1CYP2C9 | |
| SCHEMBL4773954 | 0.78 | NUDT1 (0.59) | NUDT1METAP1ALDH1A1CYP2C9NOS1 | |
| SCHEMBL4347800 | 0.78 | NUDT1 (0.55) | NUDT1KMT2AHPSEMETAP1CYP2C9 | |
| SCHEMBL31587712 | 0.78 | NUDT1 (0.55) | NUDT1KMT2AHPSEMETAP1CYP2C9 | |
| SCHEMBL7002580 | 0.78 | NUDT1 (0.58) | NUDT1METAP1ALDH1A1CYP2C9NOS1 | |
| SCHEMBL29535177 | 0.77 | CHRM1 (0.61) | NUDT1KMT2ACYP2C9NOS1NOS2 | |
| SCHEMBL30943978 | 0.77 | NUDT1 (0.58) | NUDT1KMT2AHPSEMETAP1ALDH1A1 | |
| SCHEMBL853165 | 0.77 | NUDT1 (0.58) | NUDT1KMT2AHPSEMETAP1ALDH1A1 | |
| SCHEMBL2207637 | 0.76 | MAPT (0.63) | ALDH1A1CYP2C9 |
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-1575952-B1 | SYNTHESIS OF HETEROARYL ACETAMIDES | MALLINCKRODT INC (US) | 2009-02-18 | — | — | EP | claimed |