Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | WDR5 | P61964 | 1/20 | 0.36 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CDC25B | P30305 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18986766 | 0.78 | LDHA (0.40) | KMT2AMEN1KDM4EALDH1A1NR4A1 | |
| SCHEMBL30561525 | 0.77 | HSD17B10 (0.38) | KMT2AMEN1KDM4EALDH1A1NR4A1 | |
| SCHEMBL7209262 | 0.66 | KMT2A (0.47) | KMT2AMEN1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL447966 | 0.65 | NOTUM (0.47) | KMT2AMEN1KDM4EALDH1A1HPGD | |
| SCHEMBL9697347 | 0.64 | FDPS (0.45) | KDM4EALDH1A1NR4A1NR4A2NR4A3 | |
| Acetic Acid SCHEMBL27635426 | 0.64 | MEN1 (0.51) | KMT2AMEN1KDM4EALDH1A1NR4A1 | |
| Naphthalene SCHEMBL14715817 | 0.64 | CYP2A6 (0.50) | KMT2AMEN1KDM4EALDH1A1NR4A1 | |
| SCHEMBL3830527 | 0.63 | ALDH1A1 (0.43) | KMT2AMEN1KDM4EALDH1A1NR4A1 | |
| Phenanthrene SCHEMBL11152558 | 0.63 | ALDH1A1 (0.63) | KMT2AMEN1KDM4EALDH1A1NR4A1 | |
| SCHEMBL2075524 | 0.63 | ALDH1A1 (0.38) | KMT2AMEN1KDM4EALDH1A1NR4A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2237666-A1 | HCV PROTEASE INHIBITORS AND USES THEREOF | Avila Therapeutics, Inc. (US) | 2010-10-13 | — | — | EP | disclosed |
| EP-2160392-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | Intermune, Inc. (US) | 2010-03-10 | — | — | EP | disclosed |
| WO-2009082701-A1 | HCV PROTEASE INHIBITORS AND USES THEREOF | AVILA THERAPEUTICS, INC. (US) | 2009-07-02 | — | — | WO | disclosed |
| WO-2008137779-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2008-11-13 | — | — | WO | disclosed |
| EP-1924594-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | Intermune, Inc. (US) | 2008-05-28 | — | — | EP | disclosed |
| WO-2007015824-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2007-02-08 | — | — | WO | disclosed |