Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 3/20 | 0.56 |
| ▸ | CES1 | P23141 | 2/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11401593 | 0.82 | RAB9A (0.47) | XDHSMN1; SMN2ALDH1A1L3MBTL1HPGD | |
| SCHEMBL27274457 | 0.82 | LOXL2 (0.45) | XDHSMN1; SMN2ALDH1A1L3MBTL1HPGD | |
| SCHEMBL8650517 | 0.81 | RAB9A (0.45) | XDHSMN1; SMN2ALDH1A1HPGDCYP1A2 | |
| SCHEMBL11138413 | 0.79 | NPC1 (0.48) | XDHCES1FAAHSMN1; SMN2ALDH1A1 | |
| SCHEMBL11027995 | 0.78 | XDH (0.55) | XDHSMN1; SMN2ALDH1A1MAPK1L3MBTL1 | |
| SCHEMBL21629495 | 0.78 | RAB9A (0.47) | XDHSMN1; SMN2ALDH1A1HPGDCYP2C9 | |
| SCHEMBL5469722 | 0.76 | ALDH1A1 (0.49) | XDHSMN1; SMN2ALDH1A1HPGDCYP2C9 | |
| Malonic Acid SCHEMBL10582296 | 0.75 | RAB9A (0.50) | XDHSMN1; SMN2ALDH1A1MAPK1L3MBTL1 | |
| SCHEMBL28910431 | 0.75 | XDH (0.45) | XDHSMN1; SMN2ALDH1A1HPGDMEN1 | |
| SCHEMBL2539650 | 0.74 | MEN1 (0.50) | SMN1; SMN2ALDH1A1HPGDCYP1A2CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4659360-A | HERBICIDES | FMC CORPORATION (US) | 1987-04-21 | — | — | US | disclosed |
| US-4046905-A | Anti-inflammatory, analgesic and antipyretic phenylacetic acids | MERCK & CO., INC. (US) | 1977-09-06 | — | — | US | disclosed |
| US-3947582-A | Phenylacetic acid compounds in treating abnormal platelet aggregation | MERCK & CO., INC. (US) | 1976-03-30 | — | — | US | disclosed |