Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 5/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 5/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 6/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | KMO | O15229 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2722584 | 0.89 | MKNK1 (0.58) | MKNK1MKNK2CYP2A6CYP3A4CYP2C9 | |
| SCHEMBL27768493 | 0.82 | TP53 (0.41) | KMOALDH1A1 | |
| SCHEMBL27768523 | 0.81 | CASP1 (0.38) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL9445903 | 0.76 | CYP2A6 (0.51) | MKNK1MKNK2CYP2A6CYP3A4CYP2C9 | |
| SCHEMBL2116530 | 0.75 | MARK3 (0.43) | MKNK1MKNK2CYP2A6CYP3A4CYP2C9 | |
| SCHEMBL2722587 | 0.75 | KMO (0.44) | MKNK1MKNK2CYP2A6CYP3A4CYP2C9 | |
| SCHEMBL27605086 | 0.73 | DYRK1A (0.62) | MKNK1MKNK2CYP2A6CYP3A4CYP2C9 | |
| SCHEMBL27768469 | 0.73 | CYP2A6 (0.57) | MKNK1MKNK2CYP2A6CYP3A4CYP2C9 | |
| SCHEMBL29627569 | 0.72 | CYP19A1 (0.51) | MKNK1MKNK2CYP2A6CYP3A4CYP2C9 | |
| SCHEMBL28501870 | 0.72 | CYP19A1 (0.51) | MKNK1MKNK2CYP2A6CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102850324-A | Indole compounds | MICROBIA INC | 2013-01-02 | — | — | CN | disclosed |
| CN-101563337-A | Indole compounds | MICROBIA INC (US) | 2009-10-21 | — | — | CN | disclosed |