Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 2/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | PLCG2 | P16885 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 7/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27787923 | 0.88 | APEX1 (0.53) | APEX1HRH4PLCG2MAPTMAPK1 | |
| SCHEMBL27964610 | 0.83 | GRIN2D (0.38) | HRH4MAPTKDM4ETHRBMEN1 | |
| SCHEMBL27787922 | 0.78 | APEX1 (0.46) | APEX1HRH4PLCG2MAPTMAPK1 | |
| SCHEMBL3025131 | 0.78 | MAOA (0.46) | APEX1HRH4PLCG2MAPTMAPK1 | |
| SCHEMBL1653804 | 0.76 | APEX1 (0.48) | APEX1HRH4PLCG2MAPTMAPK1 | |
| SCHEMBL1653248 | 0.73 | APEX1 (0.48) | APEX1HRH4PLCG2MAPTMAPK1 | |
| SCHEMBL29288311 | 0.73 | APEX1 (0.60) | APEX1HRH4PLCG2MAPTMAPK1 | |
| SCHEMBL1652990 | 0.72 | APEX1 (0.47) | APEX1HRH4PLCG2MAPTMAPK1 | |
| SCHEMBL3026752 | 0.72 | BRD4 (0.39) | MAPTNPC1RAB9AKDM4ENUDT1 | |
| SCHEMBL27809771 | 0.71 | KDM4E (0.40) | MAPTKDM4EMEN1HPGDKMT2A |
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-101801965-B | Indole compounds as inhibitors of cellular necrosis | LG LIFE SCIENCES LTD | 2014-07-30 | — | — | CN | disclosed |
| CN-101801965-A | Indole compounds as inhibitors of cellular necrosis | LG LIFE SCIENCES LTD | 2010-08-11 | — | — | CN | disclosed |