Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11160172 | 0.84 | JAK3 (0.37) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL11149788 | 0.84 | HDAC3 (0.43) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL13064244 | 0.78 | CA1 (0.44) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL878961 | 0.77 | CA1 (0.51) | NPC1RAB9AMAPTKMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL20820053 | 0.76 | CA1 (0.43) | MAPTMEN1KMT2AMAPK1SMN1; SMN2 | |
| SCHEMBL29639365 | 0.75 | ALDH1A1 (0.61) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL653172 | 0.75 | ALDH1A1 (0.61) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL11407168 | 0.75 | JAK3 (0.38) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL31329660 | 0.74 | ALDH1A1 (0.41) | NPC1RAB9AMEN1KMT2ANPSR1 | |
| Iodide SCHEMBL11277436 | 0.74 | JAK3 (0.38) | NPC1RAB9AMAPTMEN1KMT2A |
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-4341788-A | CARDIOTONIC AGENTS; RETARDERS; ANTIARRHYTHMIA AGENTS | C. H. BOEHRINGER SOHN (DE) | 1982-07-27 | — | — | US | disclosed |