Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11125323 | 0.87 | CYP1A2 (0.45) | TDP1CA12CA3CA4CA6 | |
| SCHEMBL15658216 | 0.85 | TLR8 (0.36) | TDP1ALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL15659078 | 0.85 | TDP1 (0.38) | TDP1CA12CA3CA4CA6 | |
| SCHEMBL15658621 | 0.84 | KCNH2 (0.38) | TDP1ALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL15656855 | 0.84 | KCNH2 (0.38) | TDP1ALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL648243 | 0.83 | TDP1 (0.37) | TDP1CA12CA3CA4CA6 | |
| SCHEMBL10757313 | 0.80 | TDP1 (0.35) | TDP1CA12CA3CA4CA6 | |
| SCHEMBL8051835 | 0.79 | CYP1A2 (0.42) | TDP1CA12CA3CA4CA6 | |
| SCHEMBL11129209 | 0.79 | CYP1A2 (0.42) | TDP1CA12CA3CA4CA6 | |
| SCHEMBL8655772 | 0.79 | CA12 (0.44) | TDP1CA12CA3CA4CA6 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0648201-B1 | ENANTIOSELECTIVE HYDROGENATION OF THE CARBONYL BOND USING RUTHENIUM COMPLEXES WITH BIPHOSPHINE LIGANDS | ELF AQUITAINE (FR) | 1997-01-22 | — | — | EP | disclosed |
| EP-0571515-B1 | CHIRAL PHOSPHINITE-BORANES, THEIR PREPARATION AND USE | ELF AQUITAINE (FR) | 1995-11-29 | — | — | EP | disclosed |
| US-5434285-A | WHICH ARE STRUCTURALLY DIFFERENT THAN THE PRIOR ART | SOCIETE NATIONALE ELF AQUITAINE (FR) | 1995-07-18 | — | — | US | disclosed |
| US-5426216-A | Employing complex of ruthenium with diphosphine and allylic ligands | SOCIETY NATIONALE ELF AQUITAINE (FR) | 1995-06-20 | — | — | US | disclosed |
| EP-0648201-A1 | Enantioselective hydrogenation of the carbonyl bond using ruthenium complexes with biphosphine ligands. | ELF AQUITAINE (FR) | 1995-04-19 | — | — | EP | disclosed |
| WO-1994001390-A1 | ENANTIOSELECTIVE CARBONYL GROUP HYDROGENATION METHOD USING RUTHENIUM/DIPHOSPHINE LIGAND COMPLEXES | ELF AQUITAINE (FR) | 1994-01-20 | — | — | WO | disclosed |
| EP-0571515-A1 | CHIRAL PHOSPHINITE-BORANES, THEIR PREPARATION AND USE. | ELF AQUITAINE (FR) | 1993-12-01 | — | — | EP | disclosed |
| US-5264602-A | Chiral phosphinite-boranes, their preparation and uses | SOCIETE NATIONALE ELF AQUITAINE (FR) | 1993-11-23 | — | — | US | disclosed |
| WO-1992014739-A1 | CHIRAL PHOSPHINITE-BORANES, THEIR PREPARATION AND USE | SOCIETE NATIONALE ELF AQUITAINE (FR) | 1992-09-03 | — | — | WO | disclosed |