Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 5/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| SCHEMBL14816113 | 0.74 | NPSR1 (0.34) | CYP1A2CYP3A4NPSR1PTGS2PTGS1 | |
| SCHEMBL9751055 | 0.74 | ALDH1A1 (0.55) | MEN1KMT2ACYP19A1IMPDH2HTT | |
| SCHEMBL11177902 | 0.67 | MAOB (0.58) | MEN1KMT2ACYP19A1HPGDMAOB | |
| SCHEMBL11171873 | 0.67 | MEN1 (0.44) | MEN1KMT2ACYP19A1HTTHPGD | |
| SCHEMBL9751004 | 0.66 | HTT (0.37) | MEN1KMT2AIMPDH2HTTHPGD | |
| SCHEMBL29430615 | 0.65 | ALDH1A1 (0.46) | HTTCYP1A2CYP3A4NPSR1ALDH1A1 | |
| SCHEMBL42756 | 0.65 | ALDH1A1 (0.46) | HTTCYP1A2CYP3A4NPSR1ALDH1A1 | |
| SCHEMBL2961732 | 0.63 | XPO1 (0.44) | MEN1KMT2AHTTHPGDCYP1A2 | |
| SCHEMBL261835 | 0.63 | ALDH1A1 (0.37) | HTTCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL9712137 | 0.63 | ALDH1A1 (0.44) | HTTCYP1A2CYP3A4SMN1; SMN2ALDH1A1 |
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 4 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-4714778-A | Alkenylated toluenediamines for use in preparing polyurethane/urea systems | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1987-12-22 | — | — | US | disclosed |