Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | NQO2 | P16083 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL64953 | 0.81 | ALDH1A1 (0.44) | CYP2A6CYP1A2NQO1KDM4ECYP11B1 | |
| SCHEMBL10470533 | 0.80 | LTA4H (0.37) | CYP1A2BRD4TDP1KDM4EPDE10A | |
| SCHEMBL2459817 | 0.80 | TLR8 (0.35) | NQO1BRD4TDP1KDM4EALDH1A1 | |
| SCHEMBL9857390 | 0.77 | RAB9A (0.40) | CYP2A6CYP1A2KDM4EALDH1A1 | |
| SCHEMBL64492 | 0.75 | BRD4 (0.39) | CYP2A6CYP1A2BRD4TDP1PDE10A | |
| SCHEMBL6672925 | 0.75 | CA1 (0.39) | TDP1KDM4EALDH1A1CA1CA2 | |
| SCHEMBL15409769 | 0.74 | ALDH1A1 (0.54) | KDM4EALDH1A1HPGDCA12CA1 | |
| SCHEMBL1776822 | 0.72 | CYP1A2 (0.38) | CYP2A6CYP1A2BRD4TDP1PDE10A | |
| SCHEMBL10822441 | 0.72 | BRD4 (0.37) | CYP2A6CYP1A2BRD4TDP1PDE10A | |
| SCHEMBL1717201 | 0.72 | BRD4 (0.37) | CYP2A6CYP1A2BRD4TDP1KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0836635-B1 | Compositions of synthetic polymers and a polysilane derivative | CIBA SC HOLDING AG (CH) | 2001-12-05 | — | — | EP | disclosed |
| US-6005036-A | ADDED TO ORGANIC MATERIAL TO PREVENT OXIDATIVE, THERMAL AND ACTINIC DEGRADATION | CIBA SPECIALTY CHEMICAL CORPORATION (US) | 1999-12-21 | — | — | US | disclosed |
| EP-0836635-A1 | Compositions of synthetic polymers and a polysilane derivative | Ciba SC Holding AG (CH) | 1998-04-22 | — | — | EP | disclosed |
| WO-1997002322-A1 | POLYSILANES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 1997-01-23 | — | — | WO | disclosed |