Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.55 |
| ▸ | EGFR | P00533 | 3/20 | 0.45 |
| ▸ | CSF1R | P07333 | 3/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 6/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 6/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CYP51A1 | Q16850 | 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 | |
|---|---|---|---|---|
| SCHEMBL12012667 | 0.84 | ACHE (0.52) | ACHEEGFRCSF1RMTNR1AMTNR1B | |
| SCHEMBL13367407 | 0.83 | ACHE (0.55) | ACHEEGFRCSF1RNPC1RAB9A | |
| SCHEMBL1697445 | 0.81 | ACHE (0.55) | ACHEEGFRCSF1RNPC1RAB9A | |
| SCHEMBL30054343 | 0.79 | MTNR1A (0.61) | ACHEMTNR1AMTNR1BHSD17B1HSD17B2 | |
| SCHEMBL1134082 | 0.79 | MTNR1A (0.61) | ACHEMTNR1AMTNR1BHSD17B1HSD17B2 | |
| SCHEMBL9853296 | 0.79 | ACHE (0.53) | ACHEEGFRCSF1RNPC1RAB9A | |
| SCHEMBL10042868 | 0.77 | MTNR1A (0.51) | ACHEEGFRCSF1RMTNR1AMTNR1B | |
| SCHEMBL22166438 | 0.77 | MTNR1A (0.60) | ACHEMTNR1AMTNR1BNPC1RAB9A | |
| SCHEMBL10042849 | 0.77 | ACHE (0.47) | ACHEEGFRCSF1RMTNR1AMTNR1B | |
| SCHEMBL8497577 | 0.77 | ACHE (0.67) | ACHEMTNR1AMTNR1BNPC1RAB9A |
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-2019032563-A1 | INHIBITORS OF BASE EXCISION REPAIR ACTIVITY AND THERAPEUTIC METHODS BASED THEREON | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2019-02-14 | — | — | WO | disclosed |