Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.63 |
| ▸ | RAB9A | P51151 | 7/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2837341 | 0.81 | MAPT (0.55) | NPC1RAB9AALDH1A1MAPK1MAPT | |
| SCHEMBL2837345 | 0.81 | MAPT (0.55) | NPC1RAB9AALDH1A1MAPK1MAPT | |
| SCHEMBL19724747 | 0.81 | MAPT (0.58) | NPC1RAB9AALDH1A1MAPK1HSD17B10 | |
| SCHEMBL10671313 | 0.79 | MAPT (0.54) | NPC1RAB9AALDH1A1MAPK1MAPT | |
| SCHEMBL27787687 | 0.79 | ALDH1A1 (0.63) | NPC1RAB9AALDH1A1MAPK1MAPT | |
| SCHEMBL12354892 | 0.79 | MAPT (0.54) | NPC1RAB9AALDH1A1MAPK1MAPT | |
| SCHEMBL5550701 | 0.78 | RAB9A (0.60) | NPC1RAB9AALDH1A1MAPK1HSD17B10 | |
| SCHEMBL24803898 | 0.78 | RAB9A (1.00) | NPC1RAB9AALDH1A1MAPK1HSD17B10 | |
| SCHEMBL7861762 | 0.77 | RAB9A (0.53) | NPC1RAB9AALDH1A1MAPK1MAPT | |
| SCHEMBL13010633 | 0.77 | ATAD2 (0.56) | NPC1RAB9AALDH1A1MAPK1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2986604-B1 | PYRIMIDINE-SUBSTITUTED PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | BOEHRINGER INGELHEIM INT (DE) | 2017-12-20 | — | — | EP | disclosed |
| EP-2948442-B1 | PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | BOEHRINGER INGELHEIM INT (DE) | 2016-10-26 | — | — | EP | disclosed |
| WO-2014114578-A1 | PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2014-07-31 | — | — | WO | disclosed |