Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 6/20 | 0.63 |
| ▸ | HTR1B | P28222 | 6/20 | 0.63 |
| ▸ | HTR1A | P08908 | 3/20 | 0.63 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 3/20 | 0.46 |
| ▸ | PTPN11 | Q06124 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8130780 | 0.96 | HTR1D (0.68) | HTR1DHTR1BHTR1ASLC2A1CYP1A2 | |
| SCHEMBL8143058 | 0.81 | HTR1D (0.90) | HTR1DHTR1BHTR1ASLC2A1CYP1A2 | |
| SCHEMBL8155545 | 0.80 | HTR1D (0.71) | HTR1DHTR1BHTR1ASLC2A1CYP1A2 | |
| SCHEMBL8128493 | 0.80 | HTR1D (0.74) | HTR1DHTR1BHTR1ASLC2A1CYP1A2 | |
| SCHEMBL8138558 | 0.80 | HTR1D (0.65) | HTR1DHTR1BHTR1ASLC2A1CYP1A2 | |
| SCHEMBL8132302 | 0.78 | HTR1D (0.62) | HTR1DHTR1BHTR1ASLC2A1CYP1A2 | |
| SCHEMBL8156189 | 0.78 | HTR1D (0.62) | HTR1DHTR1BHTR1ASLC2A1CYP1A2 | |
| SCHEMBL27542497 | 0.78 | HTR1A (0.44) | HTR1DHTR1BHTR1ASLC2A1MAPT | |
| SCHEMBL8121210 | 0.78 | HTR1A (1.00) | HTR1DHTR1BHTR1ASLC2A1CYP1A2 | |
| SCHEMBL8492299 | 0.77 | HTR1D (0.59) | HTR1DHTR1BHTR1ASLC2A1CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1260781-A | Indole derivatives having combined 5HT1A, 5HT1B and 5HT1D receptor antagonist activity | SMITHKLINE BEECHAM PLC (GB) | 2000-07-19 | — | — | CN | claimed |
| CN-1260781-A | Indole derivatives having combined 5HT1A, 5HT1B and 5HT1D receptor antagonist activity | SMITHKLINE BEECHAM PLC (GB) | 2000-07-19 | — | — | CN | disclosed |
| EP-0975593-A1 | INDOLE DERIVATIVES HAVING COMBINED 5HT1A, 5HT1B AND 5HT1D RECEPTOR ANTAGONIST ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 2000-02-02 | — | — | EP | disclosed |
| WO-1998050358-A1 | INDOLE DERIVATIVES HAVING COMBINED 5HT1A, 5HT1B AND 5HT1D RECEPTOR ANTAGONIST ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1998-11-12 | — | — | WO | disclosed |