Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | DHPS | P49366 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30197462 | 0.77 | CYP2A6 (0.58) | RAB9ANPC1DYRK1ACYP1A2CYP3A4 | |
| SCHEMBL21470169 | 0.77 | CYP2A6 (0.58) | CYP2A6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2083165 | 0.77 | CYP2A6 (0.58) | RAB9ANPC1DYRK1ACYP1A2CYP3A4 | |
| SCHEMBL34470851 | 0.70 | PPARA (0.38) | RAB9ANPC1DYRK1ACYP1A2CYP3A4 | |
| SCHEMBL497750 | 0.70 | DYRK1A (0.53) | RAB9ANPC1DYRK1ACYP1A2CYP3A4 | |
| SCHEMBL31009687 | 0.70 | CYP2A6 (0.38) | RAB9ANPC1DYRK1ACYP1A2CYP3A4 | |
| SCHEMBL3962610 | 0.70 | CYP2A6 (0.38) | RAB9ANPC1DYRK1ACYP1A2CYP3A4 | |
| SCHEMBL18878582 | 0.69 | CYP2A6 (0.41) | RAB9ANPC1DYRK1ACYP1A2CYP3A4 | |
| SCHEMBL22295857 | 0.68 | HDAC3 (0.48) | RAB9ANPC1DYRK1ACYP2A6CHRNA7 | |
| SCHEMBL6121215 | 0.67 | CYP2A6 (0.39) | RAB9ANPC1DYRK1ACYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001090105-A1 | ISOTHIAZOLES AS PESTICIDES | SYNGENTA LIMITED (GB) | 2001-11-29 | — | — | WO | disclosed |