Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | HRH2 | P25021 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | KDM4A | O75164 | 5/20 | 0.31 |
| ▸ | KDM4C | Q9H3R0 | 5/20 | 0.31 |
| ▸ | KDM5A | P29375 | 1/20 | 0.31 |
| ▸ | KDM7A | Q6ZMT4 | 1/20 | 0.31 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.31 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | GPR84 | Q9NQS5 | 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 | |
|---|---|---|---|---|
| SCHEMBL3822893 | 0.91 | ALDH1A1 (0.50) | ALDH1A1TSHRDNM1KDM4AKDM4C | |
| SCHEMBL2454527 | 0.87 | ALDH1A1 (0.47) | ALDH1A1TSHRDNM1HTR2AHRH1 | |
| SCHEMBL9671940 | 0.84 | ALDH1A1 (0.45) | ALDH1A1TSHRDNM1HTR2AHRH1 | |
| SCHEMBL18659965 | 0.84 | — | — | |
| SCHEMBL1932968 | 0.84 | — | — | |
| SCHEMBL17526769 | 0.83 | DNM1 (0.50) | ALDH1A1TSHRDNM1HTR2AHRH1 | |
| SCHEMBL2354681 | 0.83 | DNM1 (0.44) | ALDH1A1TSHRDNM1HTR2AHRH1 | |
| SCHEMBL17526552 | 0.83 | DNM1 (0.50) | ALDH1A1TSHRDNM1HTR2AHRH1 | |
| SCHEMBL17451525 | 0.82 | TSHR (0.32) | TSHRGPR84 | |
| SCHEMBL14096117 | 0.81 | DNM1 (0.33) | ALDH1A1TSHRDNM1HTR2AHRH1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3825312-A1 | INTERMEDIATES FOR PREPARING INHIBITORS OF HEPATITIS C VIRUS | Gilead Pharmasset LLC (US) | 2021-05-26 | — | — | EP | disclosed |