Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | APP | P05067 | 2/20 | 0.45 |
| ▸ | SLC16A3 | O15427 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16213446 | 0.88 | KDM4E (0.65) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL2232247 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL30494441 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL17651661 | 0.83 | IKBKB (0.55) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL28939766 | 0.77 | NPC1 (0.77) | ALDH1A1KDM4EMEN1KMT2AMAPT | |
| SCHEMBL18983569 | 0.76 | KDM4E (0.67) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL17651636 | 0.76 | PTPN11 (0.46) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL17322822 | 0.74 | KDM4E (0.49) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| Iodide SCHEMBL17780288 | 0.74 | PTPN11 (0.45) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL2231380 | 0.73 | ALDH1A1 (0.63) | ALDH1A1KDM4ELMNAMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-9353093-B2 | Indole-1-carboxamides as kinase inhibitors | ALLERGAN, INC. (US) | 2016-05-31 | — | — | US | disclosed |
| US-9353093-B2 | Indole-1-carboxamides as kinase inhibitors | ALLERGAN, INC. (US) | 2016-05-31 | — | — | US | disclosed |