Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | DGKA | P23743 | 1/20 | 0.35 |
| ▸ | SCD | O00767 | 1/20 | 0.35 |
| ▸ | CDC25A | P30304 | 6/20 | 0.35 |
| ▸ | CDC25B | P30305 | 6/20 | 0.35 |
| ▸ | CDC25C | P30307 | 5/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2142693 | 0.88 | ALDH1A1 (0.38) | ALDH1A1TDP1LMNAPOLBRECQL | |
| SCHEMBL7202715 | 0.86 | TSHR (0.48) | ALDH1A1TDP1LMNAPOLBRECQL | |
| SCHEMBL4237197 | 0.83 | ALDH1A1 (0.46) | ALDH1A1TDP1LMNAPOLBRECQL | |
| SCHEMBL8429054 | 0.82 | ALOX5 (0.44) | ALDH1A1TDP1LMNAPPARGMAPT | |
| Lithium Ion SCHEMBL8677043 | 0.80 | GPR84 (0.46) | ALDH1A1TDP1LMNAPOLBRECQL | |
| SCHEMBL7187409 | 0.78 | SCD (0.40) | ALDH1A1TDP1LMNAPOLBRECQL | |
| SCHEMBL4297676 | 0.77 | ALDH1A1 (0.40) | ALDH1A1TDP1LMNAPOLBRECQL | |
| SCHEMBL4441878 | 0.77 | ALDH1A1 (0.39) | ALDH1A1TDP1LMNAPOLBRECQL | |
| SCHEMBL11760628 | 0.75 | SCD (0.45) | ALDH1A1TDP1LMNAPOLBRECQL | |
| SCHEMBL11766118 | 0.75 | SCD (0.45) | ALDH1A1TDP1LMNAPOLBRECQL |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0920354-B1 | RUTHENIUM CATALYSTS AND THEIR USE IN THE ASYMMETRIC HYDROGENATION OF WEAKLY COORDINATING SUBSTRATES | FIRMENICH & CIE (CH) | 2003-12-03 | — | — | EP | disclosed |
| US-6455460-B1 | RU COMPLEX, A BIDENTATE DIPHOSPHINE LIGAND, ACID (HBF4, HPF6, HSBF6, HASF6, HB(3,5-(CF3)2 C6H4); ISOMER OF HEDIONE? OF +(1R)-CIS CONFIGURATION; ASYMMETRIC HYDROGENATION OF HIGHLY HINDERED CARBON-CARBON DOUBLE BONDS | FIRMENICH SA (CH) | 2002-09-24 | — | — | US | disclosed |
| US-6214763-B1 | HYDROGENATION CATALYST WITH DIPHOSPHINE AND ACID | FIRMENICH SA (CH) | 2001-04-10 | — | — | US | disclosed |
| EP-0920354-A1 | RUTHENIUM CATALYSTS AND THEIR USE IN THE ASYMMETRIC HYDROGENATION OF WEAKLY COORDINATING SUBSTRATES | FIRMENICH SA (CH) | 1999-06-09 | — | — | EP | disclosed |
| WO-1998052687-A1 | RUTHENIUM CATALYSTS AND THEIR USE IN THE ASYMMETRIC HYDROGENATION OF WEAKLY COORDINATING SUBSTRATES | FIRMENICH S.A. (CH) | 1998-11-26 | — | — | WO | disclosed |