Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.57 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ATP4A | P20648 | 1/20 | 0.37 |
| ▸ | ATP4B | P51164 | 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 | |
|---|---|---|---|---|
| SCHEMBL5762705 | 1.00 | ERBB2 (0.57) | ERBB2MINK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL5762709 | 1.00 | ERBB2 (0.57) | ERBB2MINK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL5758033 | 1.00 | ERBB2 (0.57) | ERBB2MINK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL5758915 | 0.99 | ERBB2 (0.58) | ERBB2MINK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL5758919 | 0.99 | ERBB2 (0.58) | ERBB2MINK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL780446 | 0.96 | ERBB2 (0.55) | ERBB2MINK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL780445 | 0.96 | ERBB2 (0.55) | ERBB2MINK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL5760576 | 0.93 | ERBB2 (0.50) | ERBB2MINK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL5760578 | 0.93 | ERBB2 (0.50) | ERBB2MINK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL5760683 | 0.87 | CYP19A1 (0.46) | ERBB2MINK1SMN1; SMN2NPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1270571-B1 | Heterocyclic compounds, their production and use | TAKEDA PHARMACEUTICAL (JP) | 2006-09-06 | — | — | EP | disclosed |
| EP-1270571-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-01-02 | — | — | EP | disclosed |
| US-6211215-B1 | AROMATIC HETEROCYCLIC COMPOUND WITH AZOLE COMPOUND | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-04-03 | — | — | US | disclosed |