Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 2/20 | 0.46 |
| ▸ | BCR | P11274 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.44 |
| ▸ | MAP3K8 | P41279 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20607647 | 0.92 | NPC1 (0.52) | KMT2ALMNAKDM4EABL1BCR | |
| SCHEMBL20607648 | 0.91 | NPC1 (0.48) | KMT2AKDM4EABL1BCRMEN1 | |
| SCHEMBL15558029 | 0.85 | MAPK1 (0.47) | KMT2AKDM4EMEN1SIGMAR1L3MBTL1 | |
| SCHEMBL15545286 | 0.84 | ALDH1A1 (0.52) | KMT2ALMNAKDM4EADORA2AADORA1 | |
| SCHEMBL30764865 | 0.84 | CYP3A4 (0.52) | LMNAKDM4EADORA2AADORA1ABL1 | |
| SCHEMBL21247508 | 0.84 | CYP3A4 (0.52) | LMNAKDM4EADORA2AADORA1ABL1 | |
| SCHEMBL12312314 | 0.81 | ALDH1A1 (0.50) | LMNAKDM4ERAB9A | |
| SCHEMBL3222264 | 0.80 | CD274 (0.55) | KMT2ALMNAKDM4EADORA2AADORA1 | |
| SCHEMBL20621570 | 0.80 | ADORA2A (0.48) | KMT2ALMNAKDM4EADORA2AADORA1 | |
| Water SCHEMBL28379081 | 0.79 | ADORA2A (0.47) | KMT2ALMNAKDM4EADORA2AADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2875001-B1 | NITROGENOUS HETEROCYCLIC DERIVATIVES AND THEIR APPLICATION IN DRUGS | SUNSHINE LAKE PHARMA CO LTD (CN) | 2019-01-09 | — | — | EP | disclosed |