Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.35 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2569650 | 0.87 | MAPT (0.45) | ALDH1A1CA12CA14NPC1MAPT | |
| SCHEMBL7252180 | 0.87 | KMT2A (0.48) | KMT2AALDH1A1ESR1ESR2CA12 | |
| SCHEMBL5414405 | 0.86 | MIF (0.40) | KMT2ALMNAAPPESR1ESR2 | |
| SCHEMBL1039225 | 0.86 | ALOX5 (0.39) | KMT2ALMNAAPPALDH1A1NOS1 | |
| SCHEMBL5414409 | 0.86 | MIF (0.40) | KMT2ALMNAAPPESR1ESR2 | |
| SCHEMBL2357009 | 0.86 | LMNA (0.37) | KMT2ALMNAAPPALDH1A1NOS1 | |
| SCHEMBL9995953 | 0.86 | MIF (0.40) | KMT2ALMNAAPPESR1ESR2 | |
| SCHEMBL1580054 | 0.84 | LMNA (0.36) | KMT2ALMNAAPPALDH1A1CA12 | |
| SCHEMBL27928707 | 0.84 | LMNA (0.36) | KMT2ALMNAAPPCA12CA14 | |
| SCHEMBL305032 | 0.84 | L3MBTL1 (0.45) | KMT2ALMNAALDH1A1NPSR1LTA4H |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001027096-A9 | AMINOMETHYL-(HETERO)ARYL DERIVATIVES AND THEIR USE AS TRYPTASE INHIBITORS | PROTHERICS MOLECULAR DESIGN LT (GB) | 2001-07-12 | — | — | WO | disclosed |
| WO-2001027096-A1 | AMINOMETHYL-(HETERO)ARYL DERIVATIVES AND THEIR USE AS TRYPTASE INHIBITORS | TULARIK LIMITED (GB) | 2001-04-19 | — | — | WO | disclosed |