Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | APP | P05067 | 8/20 | 0.41 |
| ▸ | TCF4 | P15884 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | TOP1 | P11387 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL4164181 | 0.77 | ACHE (0.40) | MAPTSMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL13827302 | 0.72 | ALDH1A1 (0.43) | MAPTSMN1; SMN2ALDH1A1HSD17B10APP | |
| SCHEMBL21562893 | 0.72 | ALDH1A1 (0.41) | MAPTSMN1; SMN2ALDH1A1HSD17B10NPC1 | |
| SCHEMBL21544310 | 0.72 | MAPT (0.40) | MAPTALDH1A1NPC1RAB9ACYP1A2 | |
| SCHEMBL27993181 | 0.71 | ENPP3 (0.46) | MAPTSMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL124209 | 0.69 | ALDH1A1 (0.79) | MAPTSMN1; SMN2ALDH1A1TSHRALOX15 | |
| SCHEMBL11547412 | 0.69 | ALDH1A1 (0.79) | MAPTSMN1; SMN2ALDH1A1TSHRALOX15 | |
| SCHEMBL20769886 | 0.69 | KIF11 (0.48) | NPC1RAB9AKDM4E | |
| SCHEMBL7052585 | 0.69 | APP (0.64) | MAPTSMN1; SMN2ALDH1A1TSHRALOX15 | |
| SCHEMBL10601440 | 0.69 | ALDH1A1 (0.58) | MAPTSMN1; SMN2ALDH1A1TSHRALOX15 |
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-0290591-B1 | MATERIALS WITH NITROGENOUS SIX-MEMBERED RINGS | MERCK PATENT GmbH (DE) | 1991-03-13 | — | — | EP | disclosed |
| EP-0290591-A1 | MATERIALS WITH NITROGENOUS SIX-MEMBERED RINGS. | MERCK PATENT GMBH (DE) | 1988-11-17 | — | — | EP | disclosed |
| WO-1988004305-A1 | MATERIALS WITH NITROGENOUS SIX-MEMBERED RINGS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1988-06-16 | — | — | WO | disclosed |