Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | PDE9A | O76083 | 1/20 | 0.33 |
| ▸ | HEXA | P06865 | 1/20 | 0.32 |
| ▸ | HEXB | P07686 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17180550 | 0.81 | ALDH1A1 (0.41) | TDP1ALDH1A1PTGS2CYP2A6HSD17B10 | |
| SCHEMBL9784280 | 0.81 | ACHE (0.40) | ACHEALDH1A1PTGS2AR | |
| SCHEMBL7707730 | 0.80 | MAPT (0.40) | ACHEALDH1A1PTGS2CYP2A6HSD17B10 | |
| SCHEMBL9650166 | 0.80 | TYMP (0.34) | ALDH1A1HEXAHEXB | |
| SCHEMBL5822634 | 0.76 | MAP3K14 (0.37) | TDP1ALDH1A1PTGS2ALOX15CA9 | |
| SCHEMBL28071720 | 0.76 | HRH3 (0.50) | CYP2A6 | |
| SCHEMBL14480386 | 0.74 | — | — | |
| SCHEMBL1044722 | 0.74 | MEN1 (0.47) | ACHETDP1ALDH1A1CYP2A6 | |
| SCHEMBL1044029 | 0.74 | ACHE (0.44) | ACHETDP1ALDH1A1CYP2A6HEXA | |
| SCHEMBL28387274 | 0.73 | APP (0.44) | ALDH1A1ARCYP2D6CYP2C9HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-111662338-B | Monocyclopentadienyl fourth subgroup metal complex containing neutral amine or phosphine ligand side group and its use | 吉林大学 | 2021-06-22 | — | — | CN | claimed |
| EP-2683244-A1 | HETEROCYCLIC MODULATORS OF LIPID SYNTHESIS | 3-V Biosciences, Inc. (US) | 2014-01-15 | — | — | EP | disclosed |
| WO-2012122391-A1 | HETEROCYCLIC MODULATORS OF LIPID SYNTHESIS | 3-V BIOSCIENCES, INC. (US) | 2012-09-13 | — | — | WO | disclosed |
| EP-0612758-B1 | Ferrocenyl diphosphines as ligands for homogeneous catalysts | SYNGENTA PARTICIPATIONS AG (CH) | 2003-04-09 | — | — | EP | disclosed |
| US-6508753-B2 | Hydrogenation catalyst | CHIROTECH TECHNOLOGY LIMITED (GB) | 2003-01-21 | — | — | US | disclosed |
| US-5565594-A | Ferrocene diphosphines as ligands for homogeneous catalysts | CIBA-GEIGY CORPORATION (US) | 1996-10-15 | — | — | US | disclosed |
| US-5563308-A | Ferrocene diphosphines as ligands for homogeneous catalysts | CIBA-GEIGY CORPORATION (US) | 1996-10-08 | — | — | US | disclosed |
| US-5466844-A | Ferrocene diphosphines as ligands for homogeneous catalysts | CIBA-GEIGY CORPORATION (US) | 1995-11-14 | — | — | US | disclosed |
| EP-0612758-A1 | Ferrocenyl/diphosphines as ligands for homogeneous catalysts | CIBA-GEIGY AG (CH) | 1994-08-31 | — | — | EP | disclosed |