Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939091 | 1.00 | KMT2A (0.42) | KMT2AHTR7ALDH1A1GAANPSR1 | |
| SCHEMBL14939089 | 1.00 | KMT2A (0.42) | KMT2AHTR7ALDH1A1GAANPSR1 | |
| SCHEMBL14939578 | 0.92 | KMT2A (0.44) | KMT2AALDH1A1GAANPSR1CYP2A13 | |
| SCHEMBL14939941 | 0.90 | KMT2A (0.47) | KMT2AHTR7ALDH1A1GAANPSR1 | |
| SCHEMBL14939079 | 0.90 | ALDH1A1 (0.49) | KMT2AALDH1A1GAANPSR1CYP2A13 | |
| SCHEMBL14940164 | 0.89 | KMT2A (0.43) | KMT2AALDH1A1GAANPSR1CYP2A13 | |
| SCHEMBL14939629 | 0.88 | KMT2A (0.45) | KMT2AHTR7ALDH1A1GAANPSR1 | |
| SCHEMBL14938846 | 0.88 | ALDH1A1 (0.41) | KMT2AHTR7ALDH1A1LMNAACHE | |
| SCHEMBL14941682 | 0.88 | KMT2A (0.39) | KMT2AALDH1A1GAANPSR1CYP2A13 | |
| SCHEMBL14939349 | 0.88 | ALDH1A1 (0.46) | KMT2AHTR7ALDH1A1KDM4EMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |