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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 8/20 | 0.47 |
| ▸ | SLC9A3 | P48764 | 1/20 | 0.47 |
| ▸ | SLC9A2 | Q9UBY0 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7826071 | 0.94 | ALDH1A1 (0.44) | SLC9A1SLC9A3SLC9A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL7815984 | 0.86 | ALDH1A1 (0.40) | SLC9A1SLC9A3SLC9A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL8701429 | 0.80 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL7822453 | 0.79 | SLC9A1 (0.50) | SLC9A1SLC9A3SLC9A2 | |
| Hydrochloric Acid SCHEMBL27406344 | 0.77 | SLC9A1 (0.44) | SLC9A1SLC9A3SLC9A2 | |
| SCHEMBL7830164 | 0.76 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2 | |
| Guanidine SCHEMBL8701424 | 0.76 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL8444811 | 0.76 | SLC9A1 (0.72) | SLC9A1SLC9A3SLC9A2 | |
| SCHEMBL7827452 | 0.76 | AOC2 (0.54) | SLC9A1SLC9A3SLC9A2 | |
| SCHEMBL7827503 | 0.75 | KDM4E (0.50) | SLC9A1SLC9A3SLC9A2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0699185-B1 | GUANIDINE DERIVATIVES AS INHIBITORS OF Na+ /H+ EXCHANGE IN CELLS | FUJISAWA PHARMACEUTICAL CO (JP) | 2001-09-05 | — | — | EP | disclosed |
| EP-0699185-A1 | GUANIDINE DERIVATIVES AS INHIBITORS OF Na+ /H+ EXCHANGE IN CELLS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-03-06 | — | — | EP | disclosed |