Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | HPGD | P15428 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.58 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 6/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.57 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL18271545 | 0.87 | ALDH1A1 (0.60) | ALDH1A1CYP3A4HPGDHSD17B10MEN1 | |
| SCHEMBL9479608 | 0.87 | MTNR1B (0.68) | ALDH1A1MTNR1BMTNR1AMEN1KMT2A | |
| SCHEMBL9479511 | 0.87 | MTNR1B (0.68) | ALDH1A1MTNR1BMTNR1AMEN1KMT2A | |
| SCHEMBL25569175 | 0.87 | PLAU (0.53) | MTNR1BMTNR1AMEN1KMT2AMAPT | |
| SCHEMBL1921496 | 0.87 | MTNR1B (0.72) | MTNR1BMTNR1AMEN1KMT2ANPC1 | |
| SCHEMBL1085867 | 0.87 | MEN1 (0.71) | MTNR1BMTNR1AMEN1KMT2ANPC1 | |
| SCHEMBL30273062 | 0.85 | ALDH1A1 (0.68) | ALDH1A1CYP3A4HPGDHSD17B10MEN1 | |
| SCHEMBL14300546 | 0.85 | ALDH1A1 (0.68) | ALDH1A1CYP3A4HPGDHSD17B10MEN1 | |
| SCHEMBL917608 | 0.85 | MTNR1B (0.65) | ALDH1A1MTNR1BMTNR1AMEN1KMT2A | |
| SCHEMBL30080139 | 0.85 | MTNR1B (0.65) | ALDH1A1MTNR1BMTNR1AMEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1776350-B1 | NOVEL 2-AMINO-QUINAZOLINE DERIVATIVES USEFUL AS INHIBITORS OF ß-SECRETASE ( BACE ) | JANSSEN PHARMACEUTICA NV (BE) | 2013-01-23 | — | — | EP | disclosed |
| EP-1776349-B1 | 2-AMINO-QUINAZOLINE DERIVATIVES USEFUL AS INHIBITORS OF BETA-SECRETASE (BACE) | JANSSEN PHARMACEUTICA NV (BE) | 2010-10-06 | — | — | EP | disclosed |
| EP-1789398-A1 | 2-AMINO-QUINAZOLINE DERIVATIVES USEFUL AS INHIBITORS OF B-SECRETASE (BACE) | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-05-30 | — | — | EP | disclosed |
| WO-2006024932-A1 | 2-AMINO-QUINAZOLINE DERIVATIVES USEFUL AS INHIBITORS OF B-SECRETASE (BACE) | JANSSEN PHARMACEUTICA, N.V. (US) | 2006-03-09 | — | — | WO | disclosed |