Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | CXCL8 | P10145 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL9780946 | 1.00 | ALDH1A1 (0.46) | ALDH1A1CXCL8TSHRAKR1B1FEN1 | |
| SCHEMBL1878222 | 0.83 | CXCL8 (0.51) | ALDH1A1CXCL8TSHRAKR1B1HPGD | |
| SCHEMBL6260569 | 0.81 | CXCL8 (0.53) | ALDH1A1CXCL8TSHRPOLBCYP1A2 | |
| SCHEMBL5786719 | 0.78 | PTGS1 (0.45) | ALDH1A1CXCL8HPGD | |
| SCHEMBL29107358 | 0.77 | CXCL8 (0.46) | ALDH1A1CXCL8CES2CES1 | |
| SCHEMBL2792589 | 0.76 | OGG1 (0.47) | ALDH1A1CXCL8POLBHPGDLMNA | |
| SCHEMBL11247633 | 0.76 | ALDH1A1 (0.48) | ALDH1A1TSHRAKR1B1FEN1CES2 | |
| SCHEMBL8428119 | 0.75 | CASP1 (0.48) | ALDH1A1TSHRHPGDCYP1A2LMNA | |
| SCHEMBL11250884 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHRAKR1B1CES2CES1 | |
| SCHEMBL3060819 | 0.72 | CXCL8 (0.46) | ALDH1A1CXCL8TSHRAKR1B1HPGD |
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 |