Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | JAK1 | P23458 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.46 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6119093 | 0.87 | YTHDC1 (0.47) | GRIN2BRIPK1MAPK1MEN1KMT2A | |
| SCHEMBL6119098 | 0.87 | YTHDC1 (0.47) | GRIN2BRIPK1MAPK1MEN1KMT2A | |
| SCHEMBL3375289 | 0.82 | GRIN2B (0.61) | GRIN2BSLC18A3HRH4HRH3OPRM1 | |
| SCHEMBL29173102 | 0.80 | MEN1 (0.51) | JAK2JAK1GRIN2BSLC18A3AGTR2 | |
| SCHEMBL17481972 | 0.78 | GRIN2B (0.51) | JAK2JAK1GRIN2BSLC18A3HRH4 | |
| SCHEMBL17297798 | 0.78 | GRIN2B (0.51) | JAK2JAK1GRIN2BSLC18A3HRH4 | |
| SCHEMBL17481971 | 0.78 | GRIN2B (0.51) | JAK2JAK1GRIN2BSLC18A3HRH4 | |
| SCHEMBL1306000 | 0.77 | OPRM1 (0.61) | OPRM1SIGMAR1 | |
| SCHEMBL11251947 | 0.77 | HRH3 (0.67) | GRIN2BSLC18A3HRH4HRH3OPRM1 | |
| SCHEMBL1025951 | 0.77 | HSD11B1 (0.52) | SLC18A3RIPK1HRH3L3MBTL1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3049390-A1 | SUBSTITUTED PHENYLALANINE DERIVATIVES | Bayer Pharma Aktiengesellschaft (DE) | 2016-08-03 | — | — | EP | disclosed |
| WO-2015044163-A1 | SUBSTITUTED PHENYLALANINE DERIVATIVES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2015-04-02 | — | — | WO | disclosed |