Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.59 |
| ▸ | AHR | P35869 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | CNR2 | P34972 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | BCL2 | P10415 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28584442 | 0.92 | CHRM1 (0.68) | CHRM1AHRCNR2POLBSLC22A12 | |
| SCHEMBL28584112 | 0.91 | SLC22A12 (0.58) | KDM4EALDH1A1CNR2POLBSLC22A12 | |
| SCHEMBL28587943 | 0.91 | LMNA (0.53) | KDM4EALDH1A1HPGDCNR2POLB | |
| SCHEMBL28595207 | 0.91 | POLB (0.55) | KDM4EALDH1A1HPGDCNR2POLB | |
| SCHEMBL28579240 | 0.90 | POLB (0.61) | ALDH1A1CNR2POLBSLC22A12SMN1; SMN2 | |
| SCHEMBL28571012 | 0.90 | KDM4E (0.53) | KDM4EALDH1A1HPGDCNR2POLB | |
| SCHEMBL28571008 | 0.88 | L3MBTL1 (0.52) | KDM4EALDH1A1HPGDCNR2POLB | |
| SCHEMBL28584067 | 0.88 | CNR2 (0.59) | KDM4EALDH1A1HPGDCNR2POLB | |
| SCHEMBL28584775 | 0.83 | POLB (0.54) | KDM4EALDH1A1CNR2POLBSLC22A12 | |
| SCHEMBL28595217 | 0.82 | SLC22A12 (0.63) | KDM4EALDH1A1HPGDCNR2POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-113004188-B | Indole derivative, preparation method and application | 沈阳药科大学 | 2022-09-20 | — | — | CN | disclosed |
| CN-113004188-A | Indole derivative, preparation method and application | 沈阳药科大学 | 2021-06-22 | — | — | CN | disclosed |