Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11548407 | 0.79 | ALDH1A1 (0.47) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL9527587 | 0.77 | HTR2A (0.57) | CYP3A4SRCHTR2ASLC6A4ADRA1A | |
| SCHEMBL9527580 | 0.77 | HTR2A (0.57) | CYP3A4SRCHTR2ASLC6A4ADRA1A | |
| SCHEMBL4976411 | 0.76 | SRC (0.44) | SRCSLC6A4ADRA1AADRA1DADRA1B | |
| SCHEMBL9311184 | 0.75 | ALDH1A1 (0.56) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL10560457 | 0.74 | ALDH1A1 (0.48) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL30974571 | 0.74 | ALDH1A1 (0.54) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL9536348 | 0.74 | ALDH1A1 (0.54) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL8878028 | 0.74 | SRC (0.42) | SRCMEN1KMT2A | |
| SCHEMBL7770798 | 0.74 | ALDH1A1 (0.54) | ALDH1A1GLATP53TSHRHIF1A |
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 |
|---|---|---|---|---|---|---|---|
| JP-2091058-A | — | — | None | — | — | JP | disclosed |
| JP-H0291058-A | NOVEL INDOLE COMPOUND | NIPPON STEEL CHEM CO LTD | 1990-03-30 | — | — | JP | disclosed |