Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | SPR | P35270 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4772243 | 0.80 | GAA (0.54) | GAASPRHSD17B10CYP1A2CYP3A4 | |
| Chlorobenzene SCHEMBL5800449 | 0.72 | GAA (0.45) | GAAHSD17B10CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4520325 | 0.71 | MEN1 (0.49) | GAASPRHSD17B10KDM4EMEN1 | |
| SCHEMBL7835698 | 0.70 | GAA (0.76) | GAASPRHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL31286098 | 0.70 | GAA (1.00) | GAAHSD17B10KDM4EMEN1ALDH1A1 | |
| SCHEMBL2005093 | 0.70 | GAA (1.00) | GAAHSD17B10KDM4EMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5123956 | 0.69 | SPR (0.74) | GAASPRHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL17357055 | 0.69 | GAA (0.69) | GAASPRHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL27768656 | 0.69 | KDM4E (0.49) | GAASPRHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL6825323 | 0.69 | SPR (0.60) | GAASPRHSD17B10CYP1A2CYP3A4 |
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-105916840-A | Indole compound | 安斯泰来制药株式会社 | 2016-08-31 | — | — | CN | disclosed |