Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | STAT3 | P40763 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19635117 | 0.83 | ALDH1A1 (0.36) | ALDH1A1HSD17B10MAPK1MEN1HPGD | |
| SCHEMBL23294471 | 0.75 | KDM4C (0.50) | KDM4CALDH1A1HSD17B10MAPK1MEN1 | |
| SCHEMBL29749406 | 0.75 | KDM4C (0.65) | KDM4CALDH1A1HSD17B10HCAR2MAPK1 | |
| SCHEMBL23112514 | 0.72 | KDM4C (0.61) | KDM4CALDH1A1HSD17B10HCAR2MAPK1 | |
| SCHEMBL19635175 | 0.72 | MAPT (0.46) | ALDH1A1HSD17B10MEN1HPGDKMT2A | |
| SCHEMBL19635469 | 0.72 | MAPT (0.43) | ALDH1A1HSD17B10MAPK1HPGDKMT2A | |
| SCHEMBL19635451 | 0.70 | HCAR2 (0.32) | HCAR2 | |
| SCHEMBL22303621 | 0.70 | KDM4C (0.45) | KDM4CALDH1A1HSD17B10MAPK1MEN1 | |
| SCHEMBL19635421 | 0.70 | HSD17B10 (0.42) | ALDH1A1HSD17B10HPGDKMT2ALMNA | |
| SCHEMBL11205400 | 0.69 | KDM4C (0.47) | KDM4CALDH1A1HSD17B10HCAR2MAPK1 |
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-3458459-B1 | MACROCYCLIC INDOLE DERIVATIVES | BAYER AG (DE) | 2022-04-27 | — | — | EP | disclosed |
| WO-2017198341-A1 | MACROCYCLIC INDOLE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2017-11-23 | — | — | WO | disclosed |