Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 6/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16180685 | 0.87 | NOTUM (0.48) | NOTUMCYP2A6TSHRLMNA | |
| SCHEMBL29368277 | 0.79 | CYP3A4 (0.62) | NOTUMCYP3A4MAPK1AHRTDP1 | |
| SCHEMBL348089 | 0.79 | CYP3A4 (0.62) | NOTUMCYP3A4MAPK1AHRTDP1 | |
| Benzene SCHEMBL186559 | 0.76 | CYP3A4 (0.53) | CYP3A4MAPK1AHRTDP1CYP2A6 | |
| Methane SCHEMBL23466796 | 0.75 | CYP3A4 (0.59) | NOTUMCYP3A4MAPK1AHRTDP1 | |
| SCHEMBL13664870 | 0.75 | NOTUM (0.41) | NOTUMCYP3A4MAPK1AHRCYP2A6 | |
| SCHEMBL28465925 | 0.75 | NOTUM (0.41) | NOTUMCYP3A4MAPK1AHRCYP2A6 | |
| SCHEMBL30684325 | 0.75 | NOTUM (0.41) | NOTUMCYP3A4MAPK1AHRCYP2A6 | |
| SCHEMBL30160757 | 0.75 | NOTUM (0.46) | NOTUMCYP3A4MAPK1AHRCYP2A6 | |
| SCHEMBL7926436 | 0.75 | CYP3A4 (0.46) | NOTUMCYP3A4MAPK1TDP1CYP2A6 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4158674-A | Process for displacing nuclear iodine from substituted benzenes with chlorine | THE DOW CHEMICAL COMPANY (US) | 1979-06-19 | — | — | US | claimed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |
| EP-0655434-B1 | Aromatic diamine compounds useful for electroluminescence device | NISSHIN SPINNING (JP) | 1996-09-25 | — | — | EP | disclosed |
| EP-0655434-A1 | Aromatic diamine compounds useful for electroluminescence device | NISSHINBO INDUSTRIES, INC. (JP) | 1995-05-31 | — | — | EP | disclosed |
| US-5420351-A | Charge transport compounds for electrography | NISSHINBO INDUSTRIES, INC. (JP) | 1995-05-30 | — | — | US | disclosed |
| EP-0109606-B1 | PROCESS FOR THE FORMYLATION OF ARYL HALIDES | BAYER AG (DE) | 1986-01-22 | — | — | EP | disclosed |
| US-4536344-A | USING A PHOSPINE OR PHOSPHITE | BAYER AKTIENGESELLSCHAFT (DE) | 1985-08-20 | — | — | US | disclosed |
| EP-0109606-A1 | Process for the formylation of aryl halides | BAYER AG (DE) | 1984-05-30 | — | — | EP | disclosed |
| US-4158674-A | Process for displacing nuclear iodine from substituted benzenes with chlorine | THE DOW CHEMICAL COMPANY (US) | 1979-06-19 | — | — | US | disclosed |
| US-3944498-A | Germicidal detergent containing a thienyliodonium salt | THE DOW CHEMICAL COMPANY (US) | 1976-03-16 | — | — | US | disclosed |