Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.54 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.49 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.49 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.49 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.46 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20846878 | 0.84 | HCAR2 (0.50) | HCAR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL20847151 | 0.83 | HCAR2 (0.53) | HCAR2LTB4RLTB4R2OPRM1ALDH1A1 | |
| SCHEMBL10838224 | 0.83 | HCAR2 (0.53) | HCAR2LTB4RLTB4R2OPRM1ALDH1A1 | |
| SCHEMBL14447421 | 0.82 | NCEH1 (0.40) | HCAR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9728263 | 0.81 | HCAR2 (0.51) | HCAR2LTB4RLTB4R2OPRM1ALDH1A1 | |
| SCHEMBL9774475 | 0.81 | HCAR2 (0.51) | HCAR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL4707913 | 0.81 | HCAR2 (0.51) | HCAR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL2446102 | 0.81 | HCAR2 (0.51) | HCAR2CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL26222316 | 0.80 | HCAR2 (0.50) | HCAR2LTB4RLTB4R2OPRM1ALDH1A1 | |
| SCHEMBL3786370 | 0.79 | HCAR2 (0.61) | HCAR2ALDH1A1TP53HSD17B10KMT2A |
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-2011091532-A1 | HEPATITIS C INHIBITOR COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-08-04 | — | — | WO | disclosed |