Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9750987 | 0.74 | MEN1 (0.41) | ALDH1A1CYP1A2HTTCYP3A4MEN1 | |
| SCHEMBL31403341 | 0.72 | ALDH1A1 (1.00) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL13498773 | 0.72 | ALDH1A1 (1.00) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL31123471 | 0.70 | ALDH1A1 (0.70) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL5694433 | 0.69 | ALDH1A1 (0.61) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL11171873 | 0.69 | MEN1 (0.44) | ALDH1A1CYP1A2HTTCYP3A4MEN1 | |
| SCHEMBL23642752 | 0.69 | ALDH1A1 (0.67) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL8536632 | 0.69 | ALDH1A1 (0.67) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL9751004 | 0.68 | HTT (0.37) | ALDH1A1CYP1A2HTTCYP3A4MEN1 | |
| SCHEMBL2961732 | 0.65 | XPO1 (0.44) | ALDH1A1CYP1A2HTTCYP3A4MEN1 |
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 6 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 |
| 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 |