Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.55 |
| ▸ | RAB9A | P51151 | 6/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19663875 | 0.82 | NPC1 (0.55) | MAPTRAB9ANPC1HPGDKMT2A | |
| SCHEMBL60627 | 0.81 | RAB9A (0.77) | MAPTRAB9ANPC1MAPK1KDM4E | |
| SCHEMBL16746562 | 0.81 | MAPT (0.59) | MAPTRAB9ANPC1MAPK1KDM4E | |
| SCHEMBL10001067 | 0.81 | RAB9A (0.77) | MAPTRAB9ANPC1MAPK1KDM4E | |
| SCHEMBL26355441 | 0.80 | HPGD (0.55) | MAPTRAB9ANPC1HPGDKMT2A | |
| SCHEMBL14293288 | 0.78 | NOTUM (0.59) | MAPTRAB9ANPC1MAPK1KDM4E | |
| SCHEMBL19601225 | 0.78 | MAPT (0.79) | MAPTRAB9ANPC1MAPK1KDM4E | |
| SCHEMBL8191180 | 0.78 | MAPT (0.55) | MAPTRAB9ANPC1MAPK1KDM4E | |
| SCHEMBL6686244 | 0.77 | MAPT (0.55) | MAPTRAB9ANPC1MAPK1KDM4E | |
| SCHEMBL21205039 | 0.77 | MAPT (0.55) | MAPTRAB9ANPC1MAPK1KDM4E |
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-3092229-B1 | PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2018-03-28 | — | — | EP | disclosed |