Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 5/20 | 0.49 |
| ▸ | HTR1D known ✓ | P28221 | 5/20 | 0.47 |
| ▸ | HTR1B known ✓ | P28222 | 5/20 | 0.47 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL7513247 | 0.96 | HTR1A (0.47) | HTR1AHTR1DHTR1BDRD2MTNR1A | |
| SCHEMBL7516393 | 0.90 | HTR1A (0.49) | HTR1AHTR1DHTR1BDRD2MTNR1A | |
| SCHEMBL9357232 | 0.89 | HTR1D (0.52) | HTR1AHTR1DHTR1BDRD2MTNR1A | |
| SCHEMBL7201548 | 0.86 | HTR1A (0.48) | HTR1AHTR1DHTR1BDRD2MTNR1A | |
| Phosphoric Acid SCHEMBL7509101 | 0.86 | HTR1A (0.46) | HTR1AHTR1DHTR1BDRD2MTNR1A | |
| SCHEMBL8890771 | 0.84 | HTR1D (0.47) | HTR1AHTR1DHTR1BDRD2MTNR1A | |
| SCHEMBL7519588 | 0.83 | MTNR1A (0.51) | HTR1AHTR1DHTR1BDRD2MTNR1A | |
| SCHEMBL8891553 | 0.82 | HTR1A (0.49) | HTR1AHTR1DHTR1BDRD2MTNR1A | |
| Formic Acid SCHEMBL7514970 | 0.80 | MTNR1A (0.47) | HTR1AHTR1DHTR1BDRD2MTNR1A | |
| SCHEMBL7509066 | 0.79 | MTNR1A (0.41) | HTR1AHTR1DHTR1BDRD2MTNR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1166783-A2 | Tetrahydrobenz[CD]indole-6-carboxamides for treating sexual dysfunction | ELI LILLY AND COMPANY (US) | 2002-01-02 | — | — | EP | disclosed |
| EP-0633023-A2 | Preventing emesis and treating sexual dysfunction using tetrahydrobenz CD indole-6-carboxamides | ELI LILLY AND COMPANY (US) | 1995-01-11 | — | — | EP | disclosed |
| US-4745126-A | Method of treating anxiety with tetrahydrobenz[c,d]indole-6-carboxamides | ELI LILLY AND COMPANY (US) | 1988-05-17 | — | — | US | disclosed |