Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.39 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 10/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7691111 | 0.83 | CYP3A4 (0.44) | CYP3A4ALDH1A1THRBTDP1CRHR1 | |
| SCHEMBL11033722 | 0.82 | CYP3A4 (0.39) | CYP3A4ALDH1A1ALDH3A1ALDH1A3THRB | |
| SCHEMBL7689956 | 0.75 | GAA (0.41) | CYP3A4ALDH1A1ALDH3A1ALDH1A3TDP1 | |
| SCHEMBL6816877 | 0.75 | ALDH3A1 (0.58) | CYP3A4ALDH1A1ALDH3A1ALDH1A3THRB | |
| SCHEMBL11801877 | 0.73 | TSHR (0.39) | CYP3A4ALDH3A1ALDH1A3THRBTDP1 | |
| SCHEMBL15263993 | 0.71 | ALDH3A1 (0.50) | CYP3A4ALDH1A1ALDH3A1ALDH1A3TDP1 | |
| SCHEMBL8577057 | 0.70 | ALDH1A1 (0.50) | CYP3A4ALDH1A1THRBTDP1TSHR | |
| SCHEMBL11045130 | 0.69 | CYP3A4 (0.39) | CYP3A4ALDH1A1THRBTSHRTP53 | |
| SCHEMBL13061648 | 0.67 | GRIN1 (0.34) | CYP3A4ALDH1A1THRBCHRM2CHRM3 | |
| SCHEMBL21599212 | 0.67 | CRHR1 (0.39) | ALDH1A1ALDH3A1ALDH1A3CRHR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6340596-B1 | COLORIMETRIC ANALYSIS; REACTING HYDROGEN SULFIDE WITH P-(DIALKYLAMINO)-ANILINE DERIVATIVE AND OXIDIZING AGENT UNDER ACIDIC CONDITIONS | FUJIREBIO INC. (JP) | 2002-01-22 | — | — | US | claimed |
| US-6340596-B1 | COLORIMETRIC ANALYSIS; REACTING HYDROGEN SULFIDE WITH P-(DIALKYLAMINO)-ANILINE DERIVATIVE AND OXIDIZING AGENT UNDER ACIDIC CONDITIONS | FUJIREBIO INC. (JP) | 2002-01-22 | — | — | US | disclosed |
| EP-0936466-A2 | Reagent composition for measuring hydrogen sulfide and method for measuring hydrogen sulfide | FUJIREBIO INC. (JP) | 1999-08-18 | — | — | EP | disclosed |