Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | NAAA | Q02083 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | ARG1 | P05089 | 1/20 | 0.37 |
| ▸ | ARG2 | P78540 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CPN1 | P15169 | 1/20 | 0.36 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9674013 | 0.81 | CXCR4 (0.49) | KMT2ANAAAHRH3CXCR4 | |
| SCHEMBL4385968 | 0.80 | NAAA (0.41) | KMT2ANAAAHRH3CXCR4CPN1 | |
| SCHEMBL9676455 | 0.79 | CXCR4 (0.48) | KMT2ANAAAHRH3CXCR4 | |
| SCHEMBL9673755 | 0.79 | CXCR4 (0.48) | KMT2ANAAAHRH3CXCR4 | |
| SCHEMBL4666484 | 0.79 | GNAO1 (0.41) | KMT2ANAAAHRH3CXCR4CPN1 | |
| SCHEMBL4378119 | 0.79 | CXCR4 (0.41) | KMT2ANAAAHRH3CXCR4 | |
| SCHEMBL30584772 | 0.77 | KDM4E (0.46) | KMT2AKDM4EMAPTATMCYP2D6 | |
| SCHEMBL4666468 | 0.77 | CXCR4 (0.40) | KMT2ANAAAHRH3CXCR4 | |
| Hydrochloric Acid SCHEMBL30585027 | 0.76 | KDM4E (0.45) | KMT2AKDM4EMAPTATMCYP2D6 | |
| Hydrochloric Acid SCHEMBL30584722 | 0.76 | KDM4E (0.45) | KMT2AKDM4EMAPTATMCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5175158-A | CONDENSED DIAZEPINONES, PROCESSES FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | DR. KARL THOMAE, GMBH (DE) | 1992-12-29 | — | — | US | disclosed |