Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | FPR1 | P21462 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3310645 | 1.00 | MCHR1 (0.37) | MCHR1PSIP1CYP3A4DHODHMAPT | |
| SCHEMBL244600 | 0.93 | PSIP1 (0.43) | MCHR1PSIP1CYP3A4DHODH | |
| SCHEMBL244061 | 0.93 | PSIP1 (0.43) | MCHR1PSIP1CYP3A4DHODH | |
| SCHEMBL15182608 | 0.90 | MCHR1 (0.37) | MCHR1PSIP1CYP3A4DHODH | |
| SCHEMBL3300978 | 0.86 | PSIP1 (0.39) | PSIP1CYP3A4MAPTKDM4EMEN1 | |
| SCHEMBL10284224 | 0.86 | PSIP1 (0.36) | PSIP1CYP3A4DHODHMAPTKDM4E | |
| SCHEMBL241637 | 0.85 | MCHR1 (0.36) | MCHR1PSIP1CYP3A4DHODHMAPT | |
| SCHEMBL241636 | 0.85 | MCHR1 (0.36) | MCHR1PSIP1CYP3A4DHODHMAPT | |
| SCHEMBL241635 | 0.85 | MCHR1 (0.36) | MCHR1PSIP1CYP3A4DHODHMAPT | |
| SCHEMBL245573 | 0.85 | MCHR1 (0.37) | MCHR1PSIP1CYP3A4DHODH |
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 |