Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR4 | P31391 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 5/20 | 0.39 |
| ▸ | CFTR | P13569 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL28160859 | 0.83 | CYP17A1 (0.51) | SSTR4KMT2ACHRNB2CHRNA4CYP17A1 | |
| Ammonia Solution, Strong SCHEMBL28408262 | 0.82 | CYP17A1 (0.50) | SSTR4KMT2ACHRNB2CHRNA4CYP17A1 | |
| SCHEMBL1710086 | 0.77 | KDM4E (0.45) | HTTKMT2ASMN1; SMN2CFTRALDH1A1 | |
| SCHEMBL16252776 | 0.76 | SSTR4 (0.47) | SSTR4CHRNB2CHRNA4CYP17A1AAK1 | |
| Ammonia Solution, Strong SCHEMBL28411378 | 0.76 | CYP17A1 (0.50) | SSTR4CHRNB2CHRNA4CYP17A1KDM4E | |
| Formic Acid SCHEMBL28012981 | 0.75 | SSTR4 (0.47) | SSTR4CHRNB2CHRNA4CYP17A1AAK1 | |
| SCHEMBL15350352 | 0.74 | AAK1 (0.37) | HTTKMT2ACFTRMAPK1AAK1 | |
| Ammonia Solution, Strong SCHEMBL28411555 | 0.73 | CHRNB2 (0.42) | SSTR4CHRNB2CHRNA4CYP17A1MAPT | |
| SCHEMBL14424010 | 0.72 | CA12 (0.50) | SSTR4HTTKMT2ASMN1; SMN2CHRNB2 | |
| SCHEMBL15351760 | 0.72 | AAK1 (0.37) | HTTKMT2ASMN1; SMN2CFTRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104520296-B | Pyrrolopyridinone derivatives as TTX-S blocker | 拉夸里亚创药株式会社 | 2016-11-16 | — | — | CN | disclosed |