Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 8/20 | 0.51 |
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 6/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6207873 | 0.86 | HPGDS (0.58) | HPGDSRAB9ADAOCYP1A2CYP3A4 | |
| SCHEMBL18734641 | 0.81 | DAO (0.67) | HPGDSRAB9ADAONPC1KMT2A | |
| SCHEMBL6206234 | 0.79 | HPGDS (0.58) | HPGDSRAB9ADAOCYP1A2CYP3A4 | |
| SCHEMBL14590999 | 0.77 | CES1 (0.50) | RAB9ADAOCYP3A4CYP2C19RECQL | |
| SCHEMBL29113953 | 0.77 | CES1 (0.50) | RAB9ADAOCYP3A4CYP2C19RECQL | |
| Acetic Acid SCHEMBL10593772 | 0.77 | HPGDS (0.89) | HPGDSRAB9ADAOCYP1A2CYP3A4 | |
| SCHEMBL1176681 | 0.77 | HPGDS (0.63) | HPGDSRAB9ADAOCYP1A2CYP3A4 | |
| SCHEMBL6207875 | 0.76 | HPGDS (0.58) | HPGDSRAB9ADAOCYP1A2CYP3A4 | |
| SCHEMBL6207871 | 0.76 | HPGDS (0.58) | HPGDSRAB9ADAOCYP1A2CYP3A4 | |
| SCHEMBL6206226 | 0.76 | HPGDS (0.58) | HPGDSRAB9ADAOCYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1532128-A1 | INHIBITORS OF HCV NS5B POLYMERASE | Pharmacia & Upjohn Company LLC (US) | 2005-05-25 | — | — | EP | disclosed |
| WO-2004002977-A1 | INHIBITORS OF HCV NS5B POLYMERASE | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-01-08 | — | — | WO | disclosed |