Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 4/20 | 0.43 |
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | LTK | P29376 | 1/20 | 0.43 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4577498 | 0.86 | MCHR1 (0.43) | MCHR1CA1CA2CHEK1PIM1 | |
| SCHEMBL10893204 | 0.86 | MCHR1 (0.58) | MCHR1CHEK1PIM1IDO1LTK | |
| SCHEMBL10310497 | 0.81 | KCNH2 (0.49) | HRH3CA1CA2LMNAKCNH2 | |
| SCHEMBL9364512 | 0.79 | MAPT (0.61) | MCHR1CA1CA2CHEK1PIM1 | |
| SCHEMBL3275328 | 0.79 | HRH3 (0.50) | HRH3CA1CA2MEN1KMT2A | |
| SCHEMBL10894905 | 0.78 | SIGMAR1 (0.56) | MCHR1CA1CA2CHEK1PIM1 | |
| SCHEMBL4006637 | 0.78 | ALDH1A1 (0.54) | MCHR1HRH3CA1CA2CHEK1 | |
| SCHEMBL1724150 | 0.78 | MEN1 (0.59) | CA1CA2CHEK1PIM1IDO1 | |
| SCHEMBL2182874 | 0.78 | CHEK1 (0.41) | MCHR1CA1CA2CHEK1PIM1 | |
| SCHEMBL473377 | 0.77 | DRD4 (0.52) | MCHR1CHEK1PIM1IDO1LTK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4596891-A | PHENYL-N,N'-DIETHYLETHYLENE DIAMINES | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1986-06-24 | — | — | US | disclosed |
| US-4286983-A | INCLUDING COMPOUNDS OF THE N-PHENYL-N',N'-DIETHYL ALKYLENEDIAMINE TYPE | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1981-09-01 | — | — | US | disclosed |