Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | ECE1 | P42892 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL6627049 | 0.82 | USP2 (0.40) | KMT2ACASP1 | |
| SCHEMBL6613221 | 0.82 | CASP1 (0.42) | MAPTKMT2AMEN1C3AR1LMNA | |
| SCHEMBL6609360 | 0.82 | ALDH1A1 (0.39) | MAPTKMT2AMEN1LMNACYP1A2 | |
| SCHEMBL6610908 | 0.81 | CASP3 (0.45) | CASP1 | |
| SCHEMBL6609659 | 0.79 | CASP1 (0.38) | MAPTKMT2AMEN1C3AR1LMNA | |
| SCHEMBL6777805 | 0.78 | ALDH1A1 (0.39) | KMT2AMEN1LMNATHRBCASP1 | |
| SCHEMBL6611623 | 0.78 | TSHR (0.40) | MAPTKMT2AMEN1LMNATP53 | |
| SCHEMBL6612010 | 0.77 | ALDH1A1 (0.35) | PKMMAPTKMT2AMEN1LMNA | |
| SCHEMBL6612140 | 0.77 | ALDH1A1 (0.35) | PKMMAPTKMT2AMEN1LMNA | |
| SCHEMBL6611153 | 0.76 | ALDH1A1 (0.41) | MAPTKMT2ALMNACASP1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1212309-B1 | CASPASE INHIBITOR | LG CHEM INVESTMENT LTD (KR) | 2004-08-18 | — | — | EP | disclosed |
| US-6747050-B1 | INHIBITING THE ACTIVITY OF CASPASES, PREVENTING INFLAMMATION AND APOPTOSIS | LG CHEM INVESTMENT LTD. (KR) | 2004-06-08 | — | — | US | disclosed |