Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.38 |
| ▸ | KLK1 | P06870 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PTGER1 | P34995 | 6/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18367123 | 0.85 | MEN1 (0.52) | SMN1; SMN2MEN1KMT2APKMNPC1 | |
| SCHEMBL30587516 | 0.85 | MEN1 (0.52) | SMN1; SMN2MEN1KMT2APKMNPC1 | |
| SCHEMBL18367125 | 0.82 | LMNA (0.47) | SMN1; SMN2KLKB1NPC1RAB9ARIPK1 | |
| SCHEMBL18366876 | 0.79 | RIPK1 (0.50) | MEN1KMT2ARIPK1ALDH1A1HDAC1 | |
| SCHEMBL18366877 | 0.79 | POLB (0.54) | SMN1; SMN2KLKB1KLK1MEN1KMT2A | |
| SCHEMBL30434549 | 0.79 | RIPK1 (0.50) | MEN1KMT2ARIPK1ALDH1A1HDAC1 | |
| SCHEMBL30092739 | 0.79 | POLB (0.54) | SMN1; SMN2KLKB1KLK1MEN1KMT2A | |
| SCHEMBL25761668 | 0.79 | ALDH1A1 (0.44) | KLKB1MEN1KMT2APTGER1ALDH1A1 | |
| SCHEMBL18367281 | 0.77 | KLKB1 (0.40) | KLKB1RIPK1MAPT | |
| SCHEMBL1414358 | 0.76 | KLKB1 (0.49) | KLKB1KLK1PKMRIPK1HDAC1 |
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-2023119210-A1 | NOVEL COMPOUND AS RIPK1 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | 제일약품주식회사 | 2023-06-29 | — | — | WO | disclosed |