Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | STAT3 | P40763 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19635605 | 0.88 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2TSHRALOX15ABL1 | |
| SCHEMBL19615430 | 0.86 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2TSHRALOX15ABL1 | |
| SCHEMBL19635864 | 0.78 | L3MBTL1 (0.46) | ALDH1A1SMN1; SMN2TSHRALOX15ABL1 | |
| SCHEMBL19635175 | 0.76 | MAPT (0.46) | ALDH1A1TSHRMAPTHSD17B10MEN1 | |
| SCHEMBL19634910 | 0.76 | MAPT (0.46) | ALDH1A1TSHRALOX15MAPTHSD17B10 | |
| SCHEMBL19615236 | 0.76 | LMNA (0.46) | ALDH1A1SMN1; SMN2TSHRALOX15LMNA | |
| SCHEMBL15230490 | 0.74 | PDE4D (0.56) | ALDH1A1MAPTHSD17B10MEN1KMT2A | |
| SCHEMBL19635441 | 0.73 | MAPT (0.44) | ALDH1A1SMN1; SMN2MAPTHSD17B10MEN1 | |
| SCHEMBL19635172 | 0.73 | MAPT (0.44) | ALDH1A1MAPTHSD17B10MEN1KMT2A | |
| SCHEMBL19635473 | 0.73 | MAPT (0.44) | ALDH1A1SMN1; SMN2TSHRMAPTHSD17B10 |
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 |