Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | CHIT1 | Q13231 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL626827 | 0.87 | GAA (0.76) | GAANPC1RAB9AHSD17B10CYP1A2 | |
| SCHEMBL30071250 | 0.87 | GAA (0.76) | GAANPC1RAB9AHSD17B10CYP1A2 | |
| Bromide SCHEMBL11500766 | 0.85 | GAA (0.73) | GAANPC1RAB9AHSD17B10CYP1A2 | |
| SCHEMBL16254943 | 0.78 | RIOK2 (0.60) | GAAKDM4EALDH1A1 | |
| Trifluoromethylbenzene SCHEMBL10999419 | 0.77 | ALDH1A1 (0.43) | GAANPC1RAB9AKDM4EHSD17B10 | |
| Trifluoromethylbenzene SCHEMBL10350569 | 0.77 | MEN1 (0.65) | GAANPC1RAB9ACYP1A2SMN1; SMN2 | |
| SCHEMBL18131146 | 0.77 | RAB9A (0.78) | NPC1RAB9AKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL27350716 | 0.77 | RAB9A (0.57) | GAANPC1RAB9AHSD17B10SMN1; SMN2 | |
| Trifluoromethylbenzene SCHEMBL11001765 | 0.76 | KDM4E (0.48) | NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL6245092 | 0.75 | GAA (1.00) | GAANPC1RAB9AHSD17B10CYP1A2 |
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-0183584-B1 | ESTERS OF DERIVATIVES OF 2-ALPHA-HYDROXY-SUBSTITUTED 4-HYDROXY-3-QUINOLINE CARBOXYLIC ACID, THEIR PREPARATION, THEIR USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1989-12-06 | — | — | EP | disclosed |
| EP-0183584-A1 | Esters of derivatives of 2-alpha-hydroxy-substituted 4-hydroxy-3-quinoline carboxylic acid, their preparation, their use as medicaments and compositions containing them | ROUSSEL-UCLAF (FR) | 1986-06-04 | — | — | EP | disclosed |