Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | PTGES | O14684 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7349003 | 0.76 | CYP19A1 (0.48) | MAPTTP53POLBRXFP1KDM4E | |
| SCHEMBL17432761 | 0.73 | CYP19A1 (0.48) | MAPTTP53POLBRXFP1KDM4E | |
| SCHEMBL17432759 | 0.73 | CYP19A1 (0.48) | MAPTTP53POLBRXFP1KDM4E | |
| SCHEMBL9275758 | 0.71 | CYP19A1 (0.47) | MAPTKDM4EALDH1A1HPGDL3MBTL1 | |
| SCHEMBL721861 | 0.71 | ACHE (0.65) | MAPTPOLBKDM4EALDH1A1HPGD | |
| SCHEMBL28697530 | 0.70 | BACE1 (0.60) | MAPTTP53RXFP1KDM4EALDH1A1 | |
| SCHEMBL9727963 | 0.70 | HDAC4 (0.50) | MAPTTP53KDM4EALDH1A1HPGD | |
| SCHEMBL28483481 | 0.69 | L3MBTL1 (0.50) | MAPTTP53KDM4EALDH1A1HPGD | |
| SCHEMBL28830721 | 0.69 | BACE1 (0.56) | MAPTTP53POLBKDM4EALDH1A1 | |
| SCHEMBL4752042 | 0.69 | ALDH1A1 (0.54) | MAPTPOLBKDM4EALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5206392-A | Reacting arylacetonitriles with glyoxylic acid in presence of base, hydrolyzing, cyclizing | AMERICAN CYANAMID COMPANY (US) | 1993-04-27 | — | — | US | disclosed |