Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | XBP1 | P17861 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
| ▸ | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL18740274 | 0.81 | ALDH1A1 (0.47) | ALDH1A1RAB9AMAPK1MAPTXBP1 | |
| SCHEMBL18740272 | 0.81 | ALDH1A1 (0.47) | ALDH1A1RAB9AMAPK1MAPTXBP1 | |
| SCHEMBL7792871 | 0.77 | SMN1; SMN2 (0.48) | ALDH1A1RAB9AMAPK1MAPTXBP1 | |
| SCHEMBL2882620 | 0.76 | ALDH1A1 (0.48) | ALDH1A1RAB9AMAPK1MAPTXBP1 | |
| Water SCHEMBL11778081 | 0.74 | ALDH1A1 (0.50) | ALDH1A1RAB9AMAPK1MAPTXBP1 | |
| SCHEMBL269364 | 0.74 | ALDH1A1 (0.50) | ALDH1A1RAB9AMAPK1MAPTXBP1 | |
| SCHEMBL393440 | 0.74 | ALDH1A1 (0.50) | ALDH1A1RAB9AMAPK1MAPTXBP1 | |
| SCHEMBL5671121 | 0.74 | ALDH1A1 (0.50) | ALDH1A1RAB9AMAPK1MAPTXBP1 | |
| SCHEMBL6206047 | 0.73 | ELANE (0.43) | ALDH1A1RAB9AMAPTLMNANPC1 | |
| SCHEMBL6205992 | 0.73 | ELANE (0.43) | ALDH1A1RAB9AMAPTLMNANPC1 |
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 |