Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CARM1 | Q86X55 | 2/20 | 0.36 |
| ▸ | PRMT6 | Q96LA8 | 2/20 | 0.36 |
| ▸ | XIAP | P98170 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779092 | 1.00 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2ALTA4HLNPEP | |
| SCHEMBL8779334 | 0.90 | LNPEP (0.42) | ALDH1A1MEN1KMT2ALNPEPNPSR1 | |
| SCHEMBL8779136 | 0.87 | IKBKB (0.37) | ALDH1A1LTA4HRAB9AMAPTCARM1 | |
| SCHEMBL8779325 | 0.87 | IKBKB (0.37) | ALDH1A1LTA4HRAB9AMAPTCARM1 | |
| SCHEMBL8779198 | 0.86 | LTA4H (0.46) | ALDH1A1LTA4HLNPEPRAB9AMAPT | |
| SCHEMBL8779135 | 0.86 | XIAP (0.40) | FAAHCARM1PRMT6XIAPNPC1 | |
| SCHEMBL8779278 | 0.86 | HTT (0.39) | GRM2CARM1PRMT6MAPK1 | |
| SCHEMBL8779157 | 0.86 | XIAP (0.40) | FAAHCARM1PRMT6XIAPNPC1 | |
| SCHEMBL8779165 | 0.85 | XIAP (0.38) | MEN1KMT2ALNPEPMAPTCARM1 | |
| SCHEMBL8779140 | 0.85 | REN (0.35) | LNPEPCARM1PRMT6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0661269-B1 | Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments | HOECHST AG (DE) | 1997-03-26 | — | — | EP | disclosed |
| EP-0661269-A1 | Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-07-05 | — | — | EP | disclosed |