Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 8/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.64 |
| ▸ | RAB9A | P51151 | 2/20 | 0.64 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.56 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.56 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.56 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | XBP1 | P17861 | 1/20 | 0.52 |
| ▸ | LTA4H | P09960 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | CTSV | O60911 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL5837823 | 0.89 | MEN1 (0.65) | MEN1KMT2ARAB9APDK1PDK2 | |
| SCHEMBL4358802 | 0.88 | ALDH1A1 (0.65) | MEN1KMT2ARAB9ACYP1A2CYP2C19 | |
| SCHEMBL4363172 | 0.85 | MEN1 (0.61) | MEN1KMT2ARAB9APDK1PDK2 | |
| SCHEMBL4358698 | 0.85 | MEN1 (0.61) | MEN1KMT2ARAB9APDK1PDK2 | |
| SCHEMBL13956731 | 0.84 | MEN1 (0.60) | MEN1KMT2ARAB9APDK1PDK2 | |
| SCHEMBL4361379 | 0.83 | MEN1 (0.59) | MEN1KMT2ARAB9APDK1PDK2 | |
| SCHEMBL4368072 | 0.82 | MEN1 (0.68) | MEN1KMT2ARAB9ACYP1A2CYP2C19 | |
| SCHEMBL4371842 | 0.82 | MEN1 (0.58) | MEN1KMT2ARAB9APDK1PDK2 | |
| SCHEMBL4361956 | 0.82 | ALDH1A1 (0.56) | MEN1KMT2ARAB9APDK1PDK2 | |
| SCHEMBL4371857 | 0.82 | MEN1 (0.57) | MEN1KMT2ARAB9APDK1PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7476686-B2 | Substituted aryl thioureas and related compounds; inhibitors of viral replication | ACHILLION PHARMACEUTICALS, INC. (US) | 2009-01-13 | — | — | US | disclosed |
| US-7476686-B2 | Substituted aryl thioureas and related compounds; inhibitors of viral replication | ACHILLION PHARMACEUTICALS, INC. (US) | 2009-01-13 | — | — | US | disclosed |
| US-7476686-B2 | Substituted aryl thioureas and related compounds; inhibitors of viral replication | ACHILLION PHARMACEUTICALS, INC. (US) | 2009-01-13 | — | — | US | disclosed |