Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR2 | O95136 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SSTR4 | P31391 | 4/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.31 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23909127 | 0.86 | NPC1 (0.43) | S1PR2ALDH1A1KDM4EHPGDLMNA | |
| SCHEMBL23915425 | 0.85 | S1PR2 (0.36) | S1PR2ALDH1A1KDM4EHPGDLMNA | |
| SCHEMBL18391417 | 0.69 | ELANE (0.39) | KDM4E | |
| SCHEMBL23909037 | 0.66 | NPC1 (0.44) | S1PR2ALDH1A1KDM4EHPGDLMNA | |
| SCHEMBL31560787 | 0.65 | SSTR4 (0.51) | ALDH1A1KDM4EHPGDLMNAHTT | |
| SCHEMBL23914832 | 0.65 | ALDH1A1 (0.36) | ALDH1A1KDM4EHPGDLMNAHTT | |
| SCHEMBL23909128 | 0.65 | NPC1 (0.43) | ALDH1A1KDM4EHPGDLMNAHTT | |
| SCHEMBL23914498 | 0.65 | KDM4E (0.41) | S1PR2ALDH1A1KDM4EHPGDLMNA | |
| SCHEMBL23914597 | 0.65 | ALDH1A1 (0.35) | ALDH1A1KDM4EHPGDLMNAHTT | |
| SCHEMBL23908948 | 0.65 | NPC1 (0.42) | S1PR2ALDH1A1KDM4EHPGDLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3649119-B1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS | GALAPAGOS NV (BE) | 2021-11-03 | — | — | EP | disclosed |