Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CCKBR | P32239 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | F13A1 | P00488 | 1/20 | 0.43 |
| ▸ | TGM2 | P21980 | 1/20 | 0.43 |
| ▸ | TGM1 | P22735 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10444861 | 0.94 | ITGB3 (0.46) | HTTCYP2C9CYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL7900109 | 0.85 | MAPT (0.49) | HTTCYP2C9CYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL7909493 | 0.84 | F13A1 (0.44) | HTTKMT2ASMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL8381979 | 0.81 | MAPT (0.48) | SMN1; SMN2MAPTRAB9ANPC1KDM4E | |
| SCHEMBL7909711 | 0.80 | ST14 (0.40) | HTTCYP3A4KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL9866050 | 0.80 | GAA (0.54) | HTTKMT2ASMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL9335780 | 0.79 | ITGB3 (0.50) | CYP2C9CYP3A4KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL7906634 | 0.79 | MEN1 (0.49) | KMT2AMEN1MAPTRAB9AKDM4E | |
| SCHEMBL9865134 | 0.77 | HTT (0.53) | HTTKMT2ASMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL8385674 | 0.77 | GLA (0.52) | HTTCYP2C9CYP3A4KMT2ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0372486-B1 | Benzoic-acid phenylacetic-acid derivatives, their preparation and their use as medicines | HOFFMANN LA ROCHE (CH) | 1994-06-01 | — | — | EP | disclosed |
| US-5039805-A | Novel benzoic and phenylacetic acid derivatives | HOFFMANN-LA ROCHE INC. (US) | 1991-08-13 | — | — | US | disclosed |