Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 10/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | BCR | P11274 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10117873 | 0.88 | NR1H2 (0.41) | NR1H2NR1H3MAPTIDO1USP2 | |
| SCHEMBL4062460 | 0.87 | GABRG2 (0.45) | NR1H2NR1H3MAPTUSP2TP53 | |
| SCHEMBL13663125 | 0.86 | CYP1A2 (0.49) | NR1H2NR1H3NTRK1PIM1ABL1 | |
| SCHEMBL13655089 | 0.81 | NR1H2 (0.38) | NR1H2NR1H3MAPTGABRG2GABRB3 | |
| SCHEMBL4066085 | 0.80 | FYN (0.43) | NR1H2NR1H3GABRG2GABRB3GABRA5 | |
| SCHEMBL10117875 | 0.78 | NPC1 (0.35) | NR1H2NR1H3IDO1DHFREGFR | |
| SCHEMBL4239418 | 0.78 | GABRG2 (0.44) | NR1H2NR1H3GABRG2GABRB3GABRA5 | |
| SCHEMBL10117510 | 0.77 | MEN1 (0.45) | NR1H2IDO1DHFREGFRERBB2 | |
| SCHEMBL4058194 | 0.77 | PTPN1 (0.55) | MEN1KMT2AABL1 | |
| SCHEMBL4242491 | 0.77 | GABRG2 (0.38) | NR1H2NR1H3IDO1GABRG2GABRB3 |
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-2012087976-A2 | NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2012-06-28 | — | — | WO | disclosed |