Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10841495 | 0.91 | ALDH1A1 (0.46) | ALDH1A1TDP1RAB9ANPC1TP53 | |
| SCHEMBL9839292 | 0.91 | ALDH1A1 (0.46) | ALDH1A1TDP1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL10665049 | 0.89 | CYP1A2 (0.46) | ALDH1A1TDP1POLBMEN1KMT2A | |
| SCHEMBL9601530 | 0.88 | ALDH1A1 (0.43) | ALDH1A1TDP1RAB9ANPC1TP53 | |
| SCHEMBL10353587 | 0.88 | ALDH1A1 (0.51) | ALDH1A1TDP1RAB9ANPC1TP53 | |
| SCHEMBL10665747 | 0.79 | SMN1; SMN2 (0.47) | ALDH1A1RAB9ANPC1TP53THRB | |
| SCHEMBL10353499 | 0.79 | RAB9A (0.43) | ALDH1A1RAB9ATP53HPGDPOLB | |
| SCHEMBL10668212 | 0.75 | POLB (0.57) | ALDH1A1RAB9ASMN1; SMN2POLBMEN1 | |
| SCHEMBL10737795 | 0.75 | MEN1 (0.42) | ALDH1A1TDP1RAB9ANPC1TP53 | |
| SCHEMBL10737804 | 0.74 | ALDH1A1 (0.43) | ALDH1A1TDP1RAB9ANPC1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0143123-B1 | INDUSTRIAL PRODUCTS USEFUL AS INTERMEDIATES IN THE PREPARATION OF 4-HYDROXY-3 QUINOLEINE CARBOXAMIDE DERIVATIVES SUBSTITUTED AT POSITION 2, AND THE PREPARATION OF THESE INTERMEDIATES | ROUSSEL-UCLAF (FR) | 1990-07-25 | — | — | EP | disclosed |
| EP-0143123-A2 | Industrial products useful as intermediates in the preparation of 4-hydroxy-3 quinoleine carboxamide derivatives substituted at position 2, and the preparation of these intermediates | ROUSSEL-UCLAF (FR) | 1985-06-05 | — | — | EP | disclosed |
| EP-0040573-B1 | 2-SUBSTITUTED-4-HYDROXY-3-QUINOLINECARBOXYLIC ACIDS, THEIR PREPARATION, THEIR USE AS MEDICAMENTS, COMPOSITIONS CONTAINING THEM AND INTERMEDIATES | ROUSSEL-UCLAF (FR) | 1984-08-01 | — | — | EP | disclosed |
| EP-0040573-A2 | 2-Substituted-4-hydroxy-3-quinolinecarboxylic acids, their preparation, their use as medicaments, compositions containing them and intermediates | ROUSSEL-UCLAF (FR) | 1981-11-25 | — | — | EP | disclosed |