Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 8/20 | 0.35 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | FABP3 | P05413 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL10284000 | 0.90 | KMT2A (0.35) | CYP3A4PSIP1DHODHPLA2G2AGRM2 | |
| SCHEMBL10283998 | 0.88 | EGLN1 (0.35) | CYP3A4PSIP1DHODHPLA2G2APOLB | |
| SCHEMBL3295271 | 0.87 | CYP3A4 (0.35) | CYP3A4PSIP1DHODHPLA2G2AKDM4E | |
| SCHEMBL3296191 | 0.87 | GAA (0.35) | CYP3A4PSIP1DHODHPLA2G2AGRM2 | |
| SCHEMBL10284001 | 0.86 | PLA2G2A (0.35) | CYP3A4PSIP1DHODHPLA2G2AGRM2 | |
| SCHEMBL3296258 | 0.86 | CYP3A4 (0.33) | CYP3A4PSIP1DHODHPLA2G2AGRM2 | |
| SCHEMBL10283992 | 0.85 | KDM4E (0.39) | CYP3A4PSIP1POLBKDM4EFABP3 | |
| SCHEMBL244914 | 0.84 | PSIP1 (0.51) | CYP3A4PSIP1DHODHPOLBGRM2 | |
| SCHEMBL244717 | 0.84 | PSIP1 (0.51) | CYP3A4PSIP1DHODHPOLBGRM2 | |
| SCHEMBL3312316 | 0.84 | DHODH (0.33) | CYP3A4PSIP1DHODHPLA2G2AKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012003498-A1 | 2 -QUINOLINYL- ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2012-01-05 | — | — | WO | disclosed |