Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.52 |
| ▸ | ACACB | O00763 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | NOS3 | P29474 | 1/20 | 0.45 |
| ▸ | NOS1 | P29475 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL838601 | 1.00 | CTSL (0.52) | CTSLACACBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL839454 | 1.00 | CTSL (0.52) | CTSLACACBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL838893 | 0.90 | CTSL (0.62) | CTSLACACBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL839803 | 0.90 | CTSL (0.62) | CTSLACACBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL839112 | 0.90 | CTSL (0.62) | CTSLACACBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL839237 | 0.88 | GAA (0.48) | CTSLACACBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL840376 | 0.88 | GAA (0.48) | CTSLACACBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL839741 | 0.88 | GAA (0.48) | CTSLACACBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL838462 | 0.88 | CTSL (0.52) | CTSLACACBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL840367 | 0.88 | CTSL (0.52) | CTSLACACBCYP1A2CYP3A4CYP2D6 |
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-8143052-B2 | Process for preparing optically active (S or R)-α amino acid and (R or S)-α amino acid ester in one phase organic reaction medium | UBE INDUSTRIES, LTD. (JP) | 2012-03-27 | — | — | US | disclosed |