Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.53 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | OGG1 | O15527 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.43 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1360515 | 1.00 | TDP1 (0.55) | TDP1TSHRHTR2AHTR2CHTR2B | |
| SCHEMBL14121949 | 0.89 | TDP1 (0.53) | TDP1TSHRHTR2AHTR2CHTR2B | |
| SCHEMBL11177411 | 0.86 | CYP1A2 (0.54) | TDP1TSHRHTR2AHTR2CHTR2B | |
| SCHEMBL14122864 | 0.84 | TDP1 (0.44) | TDP1TSHRHTR2AHTR2CHTR2B | |
| SCHEMBL14241287 | 0.84 | TDP1 (0.44) | TDP1TSHRHTR2AHTR2CHTR2B | |
| SCHEMBL14240871 | 0.84 | TDP1 (0.44) | TDP1TSHRHTR2AHTR2CHTR2B | |
| SCHEMBL5693377 | 0.83 | OGG1 (0.67) | TDP1TSHRHTR2AHTR2CHTR2B | |
| SCHEMBL29368187 | 0.83 | OGG1 (0.67) | TDP1TSHRHTR2AHTR2CHTR2B | |
| SCHEMBL133950 | 0.83 | OGG1 (0.67) | TDP1TSHRHTR2AHTR2CHTR2B | |
| SCHEMBL3225337 | 0.83 | OGG1 (0.67) | TDP1TSHRHTR2AHTR2CHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| US-5010060-A | Method of treating herpes simplex viral infection employing pyrimidine derivatives | HOFFMANN-LA ROCHE INC. (US) | 1991-04-23 | — | — | US | disclosed |
| US-4851519-A | AMIDO NUCLEOSIDES, VIRICIDES | HOFFMANN-LA ROCHE INC. (US) | 1989-07-25 | — | — | US | disclosed |