Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | BMP1 | P13497 | 4/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8119000 | 0.85 | PSEN1 (0.39) | BMP1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL8111790 | 0.83 | ESR1 (0.39) | POLBMAPTMC4RMC3RMC1R | |
| SCHEMBL8121919 | 0.78 | NPY1R (0.35) | OPRD1OPRK1 | |
| SCHEMBL8121501 | 0.77 | NPY1R (0.45) | BMP1MMP2MC4RMC3RMC1R | |
| SCHEMBL8120826 | 0.77 | CA12 (0.41) | NPC1RAB9ABMP1MCL1TPSAB1 | |
| SCHEMBL8112073 | 0.77 | PSEN1 (0.36) | BMP1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL8121207 | 0.76 | NPY1R (0.35) | — | |
| SCHEMBL8126402 | 0.76 | F7 (0.39) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL8123419 | 0.76 | TRPV1 (0.37) | CA12CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL8119516 | 0.75 | NPY1R (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0680469-B1 | AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME | BOEHRINGER INGELHEIM PHARMA (DE) | 2000-04-26 | — | — | EP | disclosed |