Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 3/20 | 0.57 |
| ▸ | HTR2A | P28223 | 3/20 | 0.57 |
| ▸ | HTR2C | P28335 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.52 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.52 |
| ▸ | CDK4 | P11802 | 1/20 | 0.52 |
| ▸ | CCND1 | P24385 | 1/20 | 0.52 |
| ▸ | HTR1B | P28222 | 2/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | HTR1E | P28566 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL7478879 | 0.92 | HTR1D (0.55) | HTR1DHTR2AHTR2CCYP2D6MTNR1A | |
| SCHEMBL2831695 | 0.89 | HTR2A (0.71) | HTR1DHTR2AHTR2CCYP2D6MTNR1A | |
| SCHEMBL6943874 | 0.84 | HTR1A (0.58) | HTR1DHTR2AHTR2CCYP2D6MTNR1A | |
| SCHEMBL7076438 | 0.82 | HTR1D (0.60) | HTR1DHTR2AHTR2CCDK4CCND1 | |
| SCHEMBL6945756 | 0.81 | HTR1D (0.50) | HTR1DHTR2AHTR2CCYP2D6MTNR1A | |
| SCHEMBL27374778 | 0.80 | MPO (0.61) | HTR1DHTR2AHTR2CCDK4CCND1 | |
| SCHEMBL1722931 | 0.76 | HTR1D (0.65) | HTR1DHTR2AHTR2CCYP2D6MTNR1A | |
| SCHEMBL8344495 | 0.75 | HTR1D (0.73) | HTR1DHTR2AHTR2CMTNR1AMTNR1B | |
| SCHEMBL27373453 | 0.74 | ALDH1A1 (0.44) | HTR1DHTR2AHTR2CMTNR1AMTNR1B | |
| SCHEMBL18932886 | 0.73 | HTR2A (0.71) | HTR1DHTR2AHTR2CMTNR1AMTNR1B |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0925302-B1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO INC (US) | 2002-11-20 | — | — | EP | claimed |
| CN-1322725-A | Indole derivant | MERCK & CO INC (US) | 2001-11-21 | — | — | CN | claimed |
| CN-1228094-A | Palladium catalyzed indolization | MERCK & CO INC (US) | 1999-09-08 | — | — | CN | claimed |
| CN-1152920-A | Palladium-Catalyzed Ring Closure of Triazolyl Tryptamine | MERCK & CO INC (US) | 1997-06-25 | — | — | CN | claimed |
| CN-1157390-C | Indole derivant | — | 2004-07-14 | — | — | CN | disclosed |
| EP-0925302-B1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO INC (US) | 2002-11-20 | — | — | EP | disclosed |
| CN-1084751-C | Palladium catalyzed indolization | MERCK & CO INC (US) | 2002-05-15 | — | — | CN | disclosed |
| CN-1077104-C | Palladium-Catalyzed Ring Closure of Triazolyl Tryptamine | MERCK & CO INC (US) | 2002-01-02 | — | — | CN | disclosed |
| CN-1322725-A | Indole derivant | MERCK & CO INC (US) | 2001-11-21 | — | — | CN | disclosed |
| CN-1228094-A | Palladium catalyzed indolization | MERCK & CO INC (US) | 1999-09-08 | — | — | CN | disclosed |
| CN-1152920-A | Palladium-Catalyzed Ring Closure of Triazolyl Tryptamine | MERCK & CO INC (US) | 1997-06-25 | — | — | CN | disclosed |