Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27794800 | 0.86 | CTSK (0.49) | RAB9ASCN9ACYP3A4ALDH1A1CTSL | |
| SCHEMBL14716956 | 0.86 | CTSK (0.49) | RAB9ASCN9ACYP3A4ALDH1A1CTSL | |
| SCHEMBL15311168 | 0.86 | CTSK (0.49) | RAB9ASCN9ACYP3A4ALDH1A1CTSL | |
| SCHEMBL29096483 | 0.83 | TRPA1 (0.43) | SCN9AHPGDSMN1; SMN2ADRB2ADRB1 | |
| SCHEMBL27584343 | 0.77 | CTSB (0.46) | RAB9ASCN9ACYP3A4ALDH1A1CTSL | |
| SCHEMBL28652918 | 0.76 | SCN9A (0.39) | RAB9ASCN9ACTSLCTSBCTSK | |
| SCHEMBL27917910 | 0.73 | AKT1 (0.43) | RAB9ACYP17A1CYP19A1CYP3A4POLB | |
| SCHEMBL27812309 | 0.73 | CTSK (0.48) | RAB9ASCN9ACYP3A4CTSLCTSB | |
| SCHEMBL13244840 | 0.73 | RAB9A (0.54) | RAB9ACYP17A1CYP19A1POLBHPGD | |
| SCHEMBL28579006 | 0.72 | NPC1 (0.48) | RAB9ASCN9APOLBHPGDSMN1; SMN2 |
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-1202096-C | 2-aminothiazoline derivatives and their use as no-synthase inhibitors | AVENTIS PHARMA SA (FR) | 2005-05-18 | — | — | CN | disclosed |
| CN-1444572-A | 2-aminothiazoline derivatives and their use as no-synthase inhibitors | AVENTIS PHARMA SA (FR) | 2003-09-24 | — | — | CN | disclosed |