Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 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 | |
|---|---|---|---|---|
| SCHEMBL10477482 | 0.71 | CHRNB2 (0.33) | CYP3A4 | |
| SCHEMBL10582966 | 0.71 | NR4A1 (0.42) | — | |
| SCHEMBL9819199 | 0.71 | CYP3A4 (0.39) | CYP3A4TSHRPIK3CA | |
| SCHEMBL10399467 | 0.71 | CYP3A4 (0.35) | CYP3A4 | |
| SCHEMBL9751041 | 0.70 | CYP3A4 (0.35) | CYP3A4TSHR | |
| SCHEMBL9627029 | 0.70 | CD44 (0.37) | — | |
| SCHEMBL8292041 | 0.69 | NOS3 (0.37) | — | |
| SCHEMBL6755825 | 0.69 | TRPA1 (0.39) | — | |
| SCHEMBL9750929 | 0.68 | — | — | |
| SCHEMBL10582753 | 0.68 | ALDH1A1 (0.40) | CYP3A4TSHR |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5072045-A | Polymerization inhibition using inert organic solvent | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-12-10 | — | — | US | disclosed |
| US-4985159-A | Alkenylated toluenediamines as antioxidants for organic materials | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-01-15 | — | — | US | disclosed |
| US-4845291-A | ANTIOXIDATNS, CHAIN EXTENDERS FOR POLYURETHANES AND/OR POLYUREAS | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1989-07-04 | — | — | US | disclosed |
| US-4794194-A | Alkenylated toluenediisocyanates for use in preparing polyurethane urea systems | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1988-12-27 | — | — | US | disclosed |
| EP-0272650-A1 | Diamino-beta-alkylstyrenes for use in preparing polyurethane/urea systems | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1988-06-29 | — | — | EP | disclosed |
| US-4714778-A | Alkenylated toluenediamines for use in preparing polyurethane/urea systems | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1987-12-22 | — | — | US | disclosed |
| EP-0235825-A2 | Alkenylated toluenediamines for use in preparing polyurethane/urea systems | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1987-09-09 | — | — | EP | disclosed |