Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.40 |
| ▸ | MAOB known ✓ | P27338 | 1/20 | 0.40 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.75 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.75 |
| ▸ | GABRP | O00591 | 1/20 | 0.46 |
| ▸ | GABRD | O14764 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.46 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.46 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.46 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.46 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.46 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.46 |
| ▸ | GABRE | P78334 | 1/20 | 0.46 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.46 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL27844152 | 0.89 | IMPDH2 (0.89) | IMPDH2IMPDH1GABRPGABRDGABRA1 | |
| SCHEMBL27734695 | 0.88 | IMPDH2 (0.71) | IMPDH2IMPDH1GABRPGABRDGABRA1 | |
| SCHEMBL91366 | 0.87 | IMPDH2 (1.00) | IMPDH2IMPDH1GABRPGABRDGABRA1 | |
| SCHEMBL30389000 | 0.87 | IMPDH2 (1.00) | IMPDH2IMPDH1GABRPGABRDGABRA1 | |
| Acetic Acid SCHEMBL7364790 | 0.86 | IMPDH2 (0.77) | IMPDH2IMPDH1GABRPGABRDGABRA1 | |
| SCHEMBL28194905 | 0.85 | IMPDH2 (0.96) | IMPDH2IMPDH1GABRPGABRDGABRA1 | |
| Hydrochloric Acid SCHEMBL27803164 | 0.85 | IMPDH2 (0.96) | IMPDH2IMPDH1GABRPGABRDGABRA1 | |
| SCHEMBL7365860 | 0.80 | IMPDH2 (0.63) | IMPDH2IMPDH1GABRPGABRDGABRA1 | |
| Fumaric Acid SCHEMBL28775322 | 0.80 | IMPDH2 (0.73) | IMPDH2IMPDH1GABRPGABRDGABRA1 | |
| Maleic Acid SCHEMBL28775310 | 0.80 | IMPDH2 (0.73) | IMPDH2IMPDH1GABRPGABRDGABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101389623-A | New salts of an indole derivative and their use in medicine | ASTRAZENECA AB (SE) | 2009-03-18 | — | — | CN | claimed |
| EP-1991539-A1 | NEW SALTS OF AN INDOLE DERIVATIVE AND THEIR USE IN MEDICINE | AstraZeneca AB (SE) | 2008-11-19 | — | — | EP | disclosed |
| WO-2007100282-A1 | NEW SALTS OF AN INDOLE DERIVATIVE AND THEIR USE IN MEDICINE | ASTRAZENECA AB (SE) | 2007-09-07 | — | — | WO | disclosed |