Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2B6 | P20813 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.32 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3744280 | 0.93 | CYP2B6 (0.38) | CYP2B6ALOX5POLBKMT2AMEN1 | |
| SCHEMBL4400626 | 0.86 | CYP2B6 (0.42) | CYP2B6ALOX5KMT2AMEN1CYP2C9 | |
| SCHEMBL1528523 | 0.81 | CYP2B6 (0.36) | CYP2B6ALOX5POLBKMT2AMEN1 | |
| SCHEMBL27753492 | 0.80 | CYP2B6 (0.54) | CYP2B6KMT2AMEN1CYP2C9ALDH1A1 | |
| SCHEMBL2392136 | 0.80 | CYP2B6 (0.59) | CYP2B6KMT2AMEN1CYP2C9ALDH1A1 | |
| Chlorotriphenylmethane SCHEMBL8598442 | 0.79 | CYP2B6 (0.37) | CYP2B6ALOX5CYP1A2 | |
| SCHEMBL2491599 | 0.78 | CYP2B6 (0.63) | CYP2B6KMT2AMEN1CYP2C9KDM4E | |
| SCHEMBL19296941 | 0.78 | CYP2B6 (0.63) | CYP2B6KMT2AMEN1CYP2C9KDM4E | |
| SCHEMBL9650536 | 0.76 | CYP2B6 (0.46) | CYP2B6ALDH1A1KDM4ECHRM3LMNA | |
| SCHEMBL3707837 | 0.74 | CYP2B6 (0.63) | CYP2B6POLBKMT2AMEN1CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5466687-A | Anticholesterol agents | DR. KARL THOMAE GMBH (DE) | 1995-11-14 | — | — | US | disclosed |
| EP-0596326-B1 | Arylidene-1-azacycloalkanes and arylalkyl-1-azacycloalkanes, their salts, medicaments containing the same, use thereof and precesses for their production | THOMAE GMBH DR K (DE) | 1995-08-23 | — | — | EP | disclosed |
| EP-0596326-A1 | Arylidene-1-azacycloalkanes and arylalkyl-1-azacycloalkanes, their salts, medicaments containing the same, use thereof and precesses for their production | Dr. Karl Thomae GmbH (DE) | 1994-05-11 | — | — | EP | disclosed |