Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.48 |
| ▸ | MIF | P14174 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL3718057 | 0.88 | LTA4H (0.61) | ALDH1A1 | |
| SCHEMBL11330280 | 0.86 | FOLH1 (0.48) | CYP1A2KMT2AATMMIFALDH1A1 | |
| SCHEMBL7319425 | 0.86 | CYP1A2 (0.49) | CYP1A2KMT2AATML3MBTL1ALDH1A1 | |
| SCHEMBL3658280 | 0.86 | ESR1 (0.56) | KMT2AMIF | |
| SCHEMBL7319419 | 0.86 | CYP1A2 (0.49) | CYP1A2KMT2AATML3MBTL1ALDH1A1 | |
| SCHEMBL490152 | 0.85 | CYP1A2 (0.52) | CYP1A2KMT2AATMMIFALDH1A1 | |
| SCHEMBL490150 | 0.85 | CYP1A2 (0.52) | CYP1A2KMT2AATMMIFALDH1A1 | |
| SCHEMBL19671506 | 0.84 | L3MBTL1 (0.50) | KMT2AATML3MBTL1MEN1 | |
| SCHEMBL13535255 | 0.84 | SLC1A1 (0.48) | KMT2AATMMIFALDH1A1 | |
| SCHEMBL252900 | 0.83 | CYP1A2 (0.68) | CYP1A2CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012011864-A1 | BICYCLIC COMPOUNDS AND PROCESS FOR PREPARATION | PARTNERS FÖR UTVECKLINGSINVESTERINGAR INOM LIFE SCIENCES, P.U.L.S. AB (SE) | 2012-01-26 | — | — | WO | disclosed |
| US-7247725-B2 | Gamma-aminoamide modulators of chemokine receptor activity | MERCK & CO., INC. (US) | 2007-07-24 | — | — | US | disclosed |
| US-7247725-B2 | Gamma-aminoamide modulators of chemokine receptor activity | MERCK & CO., INC. (US) | 2007-07-24 | — | — | US | disclosed |