Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7213436 | 0.89 | CYP2E1 (0.47) | ALDH1A1HPGDCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL7219105 | 0.86 | CYP2E1 (0.49) | L3MBTL1NPC1ALDH1A1HPGDCASP3 | |
| SCHEMBL4544610 | 0.82 | CCNC (0.49) | ALDH1A1HPGDCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL6472029 | 0.81 | CYP2E1 (0.48) | L3MBTL1NPC1ALDH1A1HPGDCASP3 | |
| SCHEMBL15467814 | 0.79 | HTT (0.40) | ALDH1A1SMN1; SMN2CCNCCDK8HTT | |
| SCHEMBL25092615 | 0.78 | KMT2A (0.39) | ALDH1A1SMN1; SMN2CYP2E1CYP2C8CYP2D6 | |
| SCHEMBL9587868 | 0.77 | TDP1 (0.46) | L3MBTL1ALDH1A1CYP2E1CYP2C8CYP2D6 | |
| SCHEMBL7213414 | 0.76 | L3MBTL1 (0.34) | L3MBTL1NPC1ALDH1A1HPGDCASP3 | |
| SCHEMBL6626248 | 0.75 | CYP2E1 (0.59) | ALDH1A1HPGDCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL11374174 | 0.75 | HTR1A (0.43) | NPC1ALDH1A1RAB9ACDK8HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-6603007-B1 | Intermediates in the fields of pharmaceuticals, agrichemicals, ligands, silver halide photosensitive materials, liquid crystals, surfactants, electrophotography and organic electroluminescence | SANKIO CHEMICAL CO., LTD. (JP) | 2003-08-05 | — | — | US | disclosed |
| EP-1231207-A1 | NOVEL BIPYRIDYL DERIVATIVES | Sankio Chemical Co., Ltd. (JP) | 2002-08-14 | — | — | EP | disclosed |