Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | FBP1 | P09467 | 7/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | IDO1 | P14902 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4428406 | 1.00 | RXRA (0.59) | RXRAMAPTNPSR1LMNAHPGD | |
| SCHEMBL20563977 | 0.84 | RXRA (0.50) | RXRAMAPTNPSR1LMNAHPGD | |
| SCHEMBL20563980 | 0.84 | RXRA (0.50) | RXRAMAPTNPSR1LMNAHPGD | |
| SCHEMBL21831542 | 0.80 | RXRA (0.57) | RXRAMAPTNPSR1LMNAHPGD | |
| SCHEMBL21831540 | 0.80 | RXRA (0.57) | RXRAMAPTNPSR1LMNAHPGD | |
| SCHEMBL28510880 | 0.80 | ERN1 (0.57) | RXRAMAPTNPSR1LMNAHPGD | |
| SCHEMBL28510879 | 0.80 | ERN1 (0.57) | RXRAMAPTNPSR1LMNAHPGD | |
| SCHEMBL8909959 | 0.77 | CYP2D6 (0.49) | MAPTNPSR1LMNAHPGDHTT | |
| SCHEMBL8909951 | 0.77 | CYP2D6 (0.49) | MAPTNPSR1LMNAHPGDHTT | |
| SCHEMBL20564292 | 0.76 | RXRA (0.66) | RXRAMAPTNPSR1LMNAHPGD |
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-20180187190-A1 | NEW CRISPR ASSAYS | ERASMUS UNIVERSITY MEDICAL CENTER ROTTERDAM (NL) | 2018-07-05 | — | — | US | disclosed |
| CN-104311426-A | New application of aromatic nitroethylene compound | UNIV XIAMEN | 2015-01-28 | — | — | CN | disclosed |