Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | FPR1 | P21462 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CACNB4 | O00305 | 2/20 | 0.34 |
| ▸ | CACNA1A | O00555 | 2/20 | 0.34 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.34 |
| ▸ | CACNG3 | O60359 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3300974 | 1.00 | PSIP1 (0.40) | PSIP1CYP3A4MAPTALDH1A1LMNA | |
| SCHEMBL3311296 | 0.92 | PSIP1 (0.48) | PSIP1MAPTALDH1A1LMNATDP1 | |
| SCHEMBL245279 | 0.90 | PSIP1 (0.42) | PSIP1MAPTALDH1A1LMNATDP1 | |
| SCHEMBL243591 | 0.90 | PSIP1 (0.41) | PSIP1CYP3A4MAPTALDH1A1LMNA | |
| SCHEMBL3298740 | 0.90 | PSIP1 (0.39) | PSIP1CYP3A4MAPTALDH1A1LMNA | |
| SCHEMBL243592 | 0.90 | PSIP1 (0.41) | PSIP1CYP3A4MAPTALDH1A1LMNA | |
| SCHEMBL3300978 | 0.90 | PSIP1 (0.39) | PSIP1CYP3A4MAPTALDH1A1LMNA | |
| SCHEMBL15182561 | 0.89 | PSIP1 (0.42) | PSIP1CYP3A4LMNAKDM4EHPGD | |
| SCHEMBL244717 | 0.89 | PSIP1 (0.51) | PSIP1CYP3A4KDM4EPOLB | |
| SCHEMBL244914 | 0.89 | PSIP1 (0.51) | PSIP1CYP3A4KDM4EPOLB |
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 |