Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 13/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | TSHR | P16473 | 6/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.30 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL246000 | 0.80 | DRD2 (0.30) | — | |
| SCHEMBL245999 | 0.80 | DRD2 (0.30) | — | |
| SCHEMBL252373 | 0.77 | TP53 (0.35) | TP53SMN1; SMN2 | |
| SCHEMBL252374 | 0.77 | TP53 (0.35) | TP53SMN1; SMN2 | |
| SCHEMBL244274 | 0.77 | KMT2A (0.37) | HSD17B10KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL246298 | 0.67 | TP53 (0.35) | ALDH1A1HPGDTP53CYP1A2ALOX15 | |
| SCHEMBL247064 | 0.67 | TP53 (0.35) | ALDH1A1HPGDTP53CYP1A2ALOX15 | |
| SCHEMBL247063 | 0.67 | TP53 (0.35) | ALDH1A1HPGDTP53CYP1A2ALOX15 | |
| SCHEMBL251164 | 0.65 | TP53 (0.39) | ALDH1A1HPGDTSHRTP53POLB | |
| SCHEMBL251165 | 0.65 | TP53 (0.39) | ALDH1A1HPGDTSHRTP53POLB |
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-2588455-A1 | 2 -QUINOLINYL- ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS | Gilead Sciences, Inc. (US) | 2013-05-08 | — | — | EP | disclosed |
| WO-2012003498-A1 | 2 -QUINOLINYL- ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2012-01-05 | — | — | WO | disclosed |