Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | LTA4H | P09960 | 1/20 | 0.53 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | PTPRF | P10586 | 1/20 | 0.50 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.50 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.50 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14804150 | 0.94 | HTT (0.62) | HTTCYP1A2MEN1CYP3A4CYP2C9 | |
| SCHEMBL22628164 | 0.89 | HTT (0.71) | HTTCYP1A2MEN1CYP3A4CYP2C9 | |
| N-Benzylaniline SCHEMBL7840 | 0.89 | HTT (0.71) | HTTCYP1A2MEN1CYP3A4CYP2C9 | |
| N-Benzylaniline SCHEMBL2176624 | 0.86 | HTT (0.68) | HTTCYP1A2MEN1CYP3A4CYP2C9 | |
| N-Benzylaniline SCHEMBL357137 | 0.86 | HTT (0.68) | HTTCYP1A2MEN1CYP3A4CYP2C9 | |
| N-Benzylaniline SCHEMBL27620362 | 0.86 | HTT (0.68) | HTTCYP1A2MEN1CYP3A4CYP2C9 | |
| N-Benzylaniline SCHEMBL3602124 | 0.86 | HTT (0.68) | HTTCYP1A2MEN1CYP3A4CYP2C9 | |
| N-Benzylaniline SCHEMBL10963734 | 0.84 | HTT (0.65) | HTTCYP1A2MEN1CYP3A4CYP2C9 | |
| SCHEMBL2065031 | 0.84 | CYP1A2 (0.69) | HTTCYP1A2MEN1CYP3A4CYP2C9 | |
| SCHEMBL1924100 | 0.84 | HTT (0.78) | HTTCYP1A2MEN1CYP3A4CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5767290-A | PROTECTION OF AMINE BY A TOCOPHERYL RADICAL; MILD CONDITIONS FOR DEPROTECTING; SYNTHESIS OF OLIGOPEPTIDES | BASF AKTIENGESELLSCHAFT (DE) | 1998-06-16 | — | — | US | disclosed |