Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | PNMT | P11086 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1011970 | 0.65 | MAPT (0.52) | NPC1MAPTRAB9AKMT2AADRA2A | |
| SCHEMBL19624636 | 0.65 | MAPT (0.37) | MAPTPIN1KMT2A | |
| SCHEMBL429310 | 0.64 | MAPT (0.57) | NPC1MAPTRAB9AKMT2AADRA2A | |
| SCHEMBL17242437 | 0.63 | MAPT (0.50) | NPC1MAPTRAB9AOPRK1KMT2A | |
| SCHEMBL17242431 | 0.63 | MAPT (0.36) | MAPTPIN1KMT2A | |
| Hydrochloric Acid SCHEMBL4967505 | 0.63 | MAPT (0.56) | NPC1MAPTRAB9AKMT2AADRA2A | |
| SCHEMBL12519771 | 0.62 | PIN1 (0.57) | MAPTPIN1KMT2A | |
| SCHEMBL31521404 | 0.61 | KMT2A (0.41) | MAPTKMT2A | |
| SCHEMBL30584583 | 0.60 | ALDH1A1 (0.43) | MAPTPIN1OPRK1KMT2A | |
| SCHEMBL29250710 | 0.60 | ALDH1A1 (0.43) | MAPTPIN1OPRK1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015170266-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AS BTK INHIBITORS | LUPIN LIMITED (IN) | 2015-11-12 | — | — | WO | disclosed |