Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | XPO1 | O14980 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.33 |
| ▸ | SOAT2 | O75908 | 3/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 3/20 | 0.33 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28107458 | 0.77 | CYP3A4 (0.34) | MEN1KMT2ACYP3A4CYP1A2SMN1; SMN2 | |
| SCHEMBL17998039 | 0.74 | CYP3A4 (0.39) | CYP3A4SMN1; SMN2ALDH1A1TSHRPIK3CA | |
| SCHEMBL8065484 | 0.73 | CYP3A4 (0.42) | HTTCYP3A4CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL2776271 | 0.71 | ALDH1A1 (0.40) | HTTHPGDCYP3A4SMN1; SMN2ALDH1A1 | |
| SCHEMBL28124475 | 0.71 | CYP3A4 (0.36) | CYP3A4SMN1; SMN2ALDH1A1TSHRPIK3CA | |
| SCHEMBL8538345 | 0.70 | CYP3A4 (0.39) | CYP3A4SMN1; SMN2ALDH1A1TSHRPIK3CA | |
| SCHEMBL29486322 | 0.69 | HTT (0.48) | HTTHPGDMEN1KMT2ACYP3A4 | |
| SCHEMBL24804434 | 0.68 | HTT (0.50) | HTTHPGDMEN1KMT2ACYP3A4 | |
| SCHEMBL9751055 | 0.68 | ALDH1A1 (0.55) | HTTHPGDMEN1KMT2ACYP3A4 | |
| SCHEMBL3425610 | 0.67 | GABRA1 (0.38) | HPGDCYP3A4SMN1; SMN2ALDH1A1TSHR |
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 |