Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | HPGD | P15428 | 2/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6513224 | 0.73 | CYP2A6 (0.44) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 | |
| Naphthalene SCHEMBL7097704 | 0.69 | CYP2A6 (0.89) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 | |
| SCHEMBL11948330 | 0.67 | CYP2A6 (0.44) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 | |
| SCHEMBL129937 | 0.67 | CYP2A6 (0.44) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 | |
| SCHEMBL2011178 | 0.67 | CYP2A6 (0.44) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 | |
| SCHEMBL11075959 | 0.67 | CYP2A6 (0.44) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 | |
| SCHEMBL276020 | 0.67 | CYP2A6 (0.44) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 | |
| SCHEMBL2011180 | 0.67 | CYP2A6 (0.44) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 | |
| SCHEMBL276021 | 0.67 | CYP2A6 (0.44) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 | |
| Naphthalene SCHEMBL1331142 | 0.64 | CYP2A6 (1.00) | CYP2A6ALOX12TSHRALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006101828-A1 | INSECTICIDAL ALKYLAMINO PHENYL SULFONAMIDE DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2006-09-28 | — | — | WO | claimed |
| WO-2006101828-A1 | INSECTICIDAL ALKYLAMINO PHENYL SULFONAMIDE DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2006-09-28 | — | — | WO | disclosed |