Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.47 |
| ▸ | HNF4A | P41235 | 1/20 | 0.45 |
| ▸ | ASH1L | Q9NR48 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.41 |
| ▸ | RELA | Q04206 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 2/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL18366688 | 1.00 | RIPK1 (0.47) | RIPK1HNF4AASH1LSMN1; SMN2NPC1 | |
| SCHEMBL19659306 | 0.88 | RIPK1 (0.46) | RIPK1ASH1LSMN1; SMN2NPC1NFKB1 | |
| SCHEMBL30587519 | 0.77 | AKR1B1 (0.42) | SMN1; SMN2NPC1NFKB1RAB9ANFKB2 | |
| SCHEMBL7960065 | 0.77 | AKR1A1 (0.43) | RIPK1SMN1; SMN2NPC1NFKB1RAB9A | |
| SCHEMBL14860945 | 0.75 | ASH1L (0.62) | ASH1LNPC1NFKB1RAB9ANFKB2 | |
| SCHEMBL31621268 | 0.75 | ASH1L (0.62) | ASH1LNPC1NFKB1RAB9ANFKB2 | |
| SCHEMBL836745 | 0.72 | SMN1; SMN2 (0.65) | SMN1; SMN2NPC1NFKB1RAB9ANFKB2 | |
| SCHEMBL28727291 | 0.72 | SMN1; SMN2 (0.65) | SMN1; SMN2NPC1NFKB1RAB9ANFKB2 | |
| SCHEMBL6068377 | 0.71 | NPC1 (0.64) | SMN1; SMN2NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL3610419 | 0.70 | SMN1; SMN2 (0.63) | SMN1; SMN2NPC1NFKB1RAB9ANFKB2 |
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-111269221-B | Bicyclic lactams and methods of use thereof | 豪夫迈·罗氏有限公司 | 2023-09-26 | — | — | CN | disclosed |