Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | DPP4 | P27487 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GPR88 | Q9GZN0 | 7/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL28062252 | 0.81 | KDM4E (0.41) | KDM4EHSD17B10CASP1 | |
| SCHEMBL28168522 | 0.80 | NPC1 (0.47) | KDM4EHSD17B10DPP4ALDH1A1NPC1 | |
| SCHEMBL899802 | 0.80 | NPC1 (0.47) | KDM4EHSD17B10DPP4ALDH1A1NPC1 | |
| 2-Chloropyridine SCHEMBL27562267 | 0.74 | TDP1 (0.55) | KDM4EHSD17B10CASP1ALDH1A1NPC1 | |
| 2-Aminopyridine SCHEMBL27810269 | 0.74 | NOS3 (0.55) | KDM4EHSD17B10CASP1ALDH1A1NPC1 | |
| Ethoxycarbonyl Group SCHEMBL27633949 | 0.72 | LMNA (0.40) | KDM4EHSD17B10CASP1ALDH1A1MAPT | |
| Ethoxycarbonyl Group SCHEMBL28034362 | 0.72 | HRH1 (0.44) | KDM4EALDH1A1ADRA2AADRA2BADRA2C | |
| Ethoxycarbonyl Group SCHEMBL27921478 | 0.71 | ALDH1A1 (0.44) | KDM4EALDH1A1 | |
| Ethoxycarbonyl Group SCHEMBL27617766 | 0.71 | ADRA2A (0.38) | KDM4EHSD17B10CASP1ALDH1A1NPC1 | |
| Ethoxycarbonyl Group SCHEMBL27939991 | 0.71 | TSHR (0.38) | KDM4EALDH1A1NPC1MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102947292-B | nitrogen-containing heteroaryl compounds | HOFFMAN-LA ROCHE LTD. (CH) | 2015-08-19 | — | — | CN | disclosed |