Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.62 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.53 |
| ▸ | EPAS1 | Q99814 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL27652930 | 1.00 | TNF (0.62) | TNFHDAC1HDAC8HDAC6CYP2C9 | |
| SCHEMBL27672992 | 0.99 | HDAC1 (0.61) | TNFHDAC1HDAC8HDAC6CYP2C9 | |
| SCHEMBL27652919 | 0.96 | HDAC6 (0.57) | TNFHDAC1HDAC8HDAC6CYP2C9 | |
| SCHEMBL27672978 | 0.87 | HIF1A (0.71) | CYP2C9ALDH1A1CYP1A2CYP2D6ALOX15 | |
| SCHEMBL28759315 | 0.87 | HDAC1 (0.53) | TNFHDAC1HDAC6KDM4EALDH1A1 | |
| SCHEMBL27672993 | 0.86 | RAB9A (0.66) | TNFHDAC6KDM4EALDH1A1RAB9A | |
| SCHEMBL27673031 | 0.86 | NPC1 (0.54) | RAB9AHIF1AEPAS1NPC1HRH3 | |
| SCHEMBL27672979 | 0.84 | RAB9A (0.52) | TNFHDAC6KDM4EALDH1A1RAB9A | |
| SCHEMBL27652928 | 0.84 | HIF1A (0.47) | TNFHDAC6KDM4EALDH1A1RAB9A | |
| SCHEMBL28663251 | 0.81 | RAB9A (0.76) | TNFHDAC1HDAC8HDAC6CYP2C9 |
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-1946395-A | 1H-thieno [2, 3-c ] pyrazole derivatives useful as kinase inhibitors | PHARMACIA ITALIA SPA (IT) | 2007-04-11 | — | — | CN | claimed |
| CN-1946395-A | 1H-thieno [2, 3-c ] pyrazole derivatives useful as kinase inhibitors | PHARMACIA ITALIA SPA (IT) | 2007-04-11 | — | — | CN | disclosed |