Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.53 |
| ▸ | BCHE | P06276 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.43 |
| ▸ | MIF | P14174 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9506413 | 0.94 | ACHE (0.67) | ACHEPTGS2BCHECYP1A2KMT2A | |
| SCHEMBL29264644 | 0.85 | PTGS2 (0.71) | ACHEPTGS2KMT2AMAPTMEN1 | |
| SCHEMBL1416418 | 0.83 | S100B (0.45) | ACHEPTGS2BCHECYP1A2KMT2A | |
| SCHEMBL1416417 | 0.83 | S100B (0.45) | ACHEPTGS2BCHECYP1A2KMT2A | |
| SCHEMBL9342036 | 0.78 | ACHE (0.49) | ACHECYP1A2KMT2AMAPTMEN1 | |
| SCHEMBL11319345 | 0.78 | ACHE (0.49) | ACHECYP1A2KMT2AMAPTMEN1 | |
| SCHEMBL9168847 | 0.78 | PTGS2 (0.69) | ACHEPTGS2BCHEKMT2AMAPT | |
| SCHEMBL29286007 | 0.77 | ACHE (0.65) | ACHEPTGS2BCHECYP1A2KMT2A | |
| SCHEMBL2868624 | 0.74 | CYP1A2 (0.86) | CYP1A2KMT2AMAPTMEN1LMNA | |
| SCHEMBL11966165 | 0.74 | CYP1A2 (0.86) | CYP1A2KMT2AMAPTMEN1LMNA |
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-0364120-B1 | A CYCLOALKENE COMPOUND AND A RECORDING MATERIAL USING THE COMPOUND | HODOGAYA CHEMICAL COMPANY, LIMITED (JP) | 1993-08-11 | — | — | EP | disclosed |
| US-4987262-A | Absorbers of near infrared radiation, chromogens | HODOGAYA CHEMICAL CO., LTD. (JP) | 1991-01-22 | — | — | US | disclosed |
| EP-0364120-A2 | A cycloalkene compound and a recording material using the compound | HODOGAYA CHEMICAL COMPANY, LIMITED (JP) | 1990-04-18 | — | — | EP | disclosed |