Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SYK | P43405 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 2/20 | 0.39 |
| ▸ | RXRB | P28702 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | FABP1 | P07148 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17835017 | 0.91 | RXRA (0.46) | SYKFFAR4HTR1ARXRARXRB | |
| SCHEMBL11667711 | 0.78 | KMT2A (0.47) | PTGS2MEN1KMT2AALDH1A1TSHR | |
| SCHEMBL7986906 | 0.73 | MAPT (0.54) | SYKMEN1KMT2AALDH1A1TSHR | |
| SCHEMBL22753498 | 0.72 | NQO1 (0.46) | PTGS2MEN1KMT2AALDH1A1TSHR | |
| SCHEMBL11518974 | 0.71 | SYK (0.57) | SYKMEN1KMT2AALDH1A1TSHR | |
| SCHEMBL14139485 | 0.71 | RXRA (0.59) | FFAR4PTGS2RXRARXRBMAPT | |
| SCHEMBL18872971 | 0.71 | ALDH1A1 (0.58) | SYKPTGS2MEN1KMT2AALDH1A1 | |
| SCHEMBL25912532 | 0.71 | ALDH1A1 (0.64) | SYKPTGS2MEN1KMT2AALDH1A1 | |
| SCHEMBL12124937 | 0.70 | TP53 (0.55) | RXRARXRBKMT2AALDH1A1TSHR | |
| SCHEMBL28166768 | 0.69 | RXRA (0.53) | PTGS2RXRARXRBALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3230403-B1 | ORGANIC COMPOUNDS WITH SOLUBLE GROUPS | MERCK PATENT GMBH (DE) | 2019-10-09 | — | — | EP | disclosed |