Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 4/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | NSD2 | O96028 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2882619 | 0.75 | HSD17B10 (0.47) | HSD17B10RAB9ANPC1ELANEAKR1C3 | |
| SCHEMBL6204762 | 0.74 | ELANE (0.53) | ELANECYP1A2PARP10NSD2TDP1 | |
| SCHEMBL21457582 | 0.74 | ALDH1A1 (0.46) | HSD17B10RAB9AHPGDCYP3A4CYP2C19 | |
| SCHEMBL6206652 | 0.73 | ELANE (0.43) | HSD17B10ELANEAKR1C3HPGDCYP1A2 | |
| SCHEMBL6205997 | 0.73 | ELANE (0.43) | HSD17B10ELANEAKR1C3HPGDCYP1A2 | |
| SCHEMBL6206639 | 0.73 | ELANE (0.43) | HSD17B10ELANEAKR1C3HPGDCYP1A2 | |
| SCHEMBL6206053 | 0.73 | ELANE (0.43) | HSD17B10ELANEAKR1C3HPGDCYP1A2 | |
| SCHEMBL6206776 | 0.72 | NPC1 (0.41) | HSD17B10RAB9ANPC1ELANEAKR1C3 | |
| SCHEMBL6206774 | 0.72 | ALDH1A1 (0.42) | HSD17B10RAB9ANPC1ELANEAKR1C3 | |
| SCHEMBL291408 | 0.72 | CYP2C19 (0.43) | HSD17B10RAB9AHPGDCYP1A2CYP3A4 |
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 |