Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.39 |
| ▸ | GALR2 | O43603 | 1/20 | 0.39 |
| ▸ | GALR1 | P47211 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6879219 | 1.00 | ALDH1A1 (0.55) | ALDH1A1BCHEACHEMCHR1TP53 | |
| SCHEMBL6878342 | 0.91 | ALDH1A1 (0.43) | ALDH1A1MCHR1ADRA2APRMT5WDR77 | |
| SCHEMBL6878336 | 0.91 | ALDH1A1 (0.43) | ALDH1A1MCHR1ADRA2APRMT5WDR77 | |
| SCHEMBL6462936 | 0.90 | ALDH1A1 (0.51) | ALDH1A1BCHEACHEMCHR1ADRA2A | |
| SCHEMBL6873997 | 0.90 | ALDH1A1 (0.51) | ALDH1A1BCHEACHEMCHR1ADRA2A | |
| SCHEMBL6866808 | 0.87 | LMNA (0.60) | ALDH1A1BCHEACHEMCHR1TP53 | |
| SCHEMBL6866804 | 0.87 | LMNA (0.60) | ALDH1A1BCHEACHEMCHR1TP53 | |
| SCHEMBL6456764 | 0.85 | POLB (0.48) | ALDH1A1MCHR1TP53MAPTADRA2A | |
| SCHEMBL6456777 | 0.85 | POLB (0.48) | ALDH1A1MCHR1TP53MAPTADRA2A | |
| SCHEMBL6874187 | 0.84 | ADRA2A (0.45) | ALDH1A1MCHR1MAPTADRA2ATSHR |
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-1464335-A2 | Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist | Taisho Pharmaceutical Co. Ltd. (JP) | 2004-10-06 | — | — | EP | disclosed |