Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | HTR2A | P28223 | 1/20 | 0.62 |
| ▸ | HTR2C | P28335 | 1/20 | 0.62 |
| ▸ | HTR2B | P41595 | 1/20 | 0.62 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.52 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.52 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 6/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9780791 | 1.00 | TSHR (0.62) | TSHRHTR2AHTR2CHTR2BPTGDR2 | |
| SCHEMBL11274470 | 0.87 | PDE7A (0.61) | TSHRHTR2AHTR2CHTR2BLMNA | |
| SCHEMBL11092193 | 0.86 | TSHR (0.50) | TSHRHTR2AHTR2CHTR2BPTGDR2 | |
| SCHEMBL11191404 | 0.86 | PDE7A (0.53) | TSHRHTR2AHTR2CHTR2BPTGDR2 | |
| SCHEMBL3586660 | 0.84 | TTR (0.55) | TSHRHTR2AHTR2CHTR2BPDK1 | |
| SCHEMBL7824974 | 0.84 | TTR (0.55) | TSHRHTR2AHTR2CHTR2BPDK1 | |
| SCHEMBL11583795 | 0.84 | PDE7A (0.49) | TSHRHTR2AHTR2CHTR2BPDK1 | |
| SCHEMBL19175613 | 0.83 | PDK1 (0.61) | TSHRPDK1LMNAMAPTALDH1A1 | |
| SCHEMBL16823536 | 0.83 | PDK1 (0.48) | TSHRHTR2AHTR2CHTR2BPDK1 | |
| SCHEMBL16823541 | 0.83 | PDK1 (0.48) | TSHRHTR2AHTR2CHTR2BPDK1 |
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 |