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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB known ✓ | P27338 | 3/20 | 0.50 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.51 |
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.45 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.45 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.45 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8935302 | 1.00 | SCN9A (0.51) | SCN9AMAOBMAOAPLA2G10PLA2G2A | |
| SCHEMBL7399338 | 0.94 | SCN9A (0.55) | SCN9AMAOBMAOAPLA2G10PLA2G2A | |
| SCHEMBL7401755 | 0.94 | SCN9A (0.55) | SCN9AMAOBMAOAPLA2G10PLA2G2A | |
| SCHEMBL1790979 | 0.88 | SCN9A (0.57) | SCN9AMAOBMAOAITGB1ITGA5 | |
| SCHEMBL411692 | 0.88 | SCN9A (0.57) | SCN9AMAOBMAOAITGB1ITGA5 | |
| Hydrochloric Acid SCHEMBL5966887 | 0.86 | SCN9A (0.56) | SCN9AMAOBMAOAITGB1ITGA5 | |
| SCHEMBL7395231 | 0.85 | SCN9A (0.55) | SCN9AMAOBMAOAITGB1ITGA5 | |
| SCHEMBL7395238 | 0.85 | SCN9A (0.55) | SCN9AMAOBMAOAITGB1ITGA5 | |
| SCHEMBL3289039 | 0.85 | SCN9A (0.55) | SCN9AMAOBMAOAITGB1ITGA5 | |
| SCHEMBL3290662 | 0.85 | SCN9A (0.55) | SCN9AMAOBMAOAITGB1ITGA5 |
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-5502079-A | TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS | FARMITALIA CARLO ERBA S.R.L. (IT) | 1996-03-26 | — | — | US | disclosed |
| US-5391577-A | Active on central nervous system; antiepileptic agents | FARMITALIA CARLO ERBA S R L (IT) | 1995-02-21 | — | — | US | disclosed |
| US-5236957-A | Antiepileptic agents | FARMITALIA CARLO ERBA SRL (IT) | 1993-08-17 | — | — | US | disclosed |