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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 16/20 | 0.77 |
| ▸ | CASP3 | P42574 | 1/20 | 0.77 |
| ▸ | CASP7 | P55210 | 1/20 | 0.77 |
| ▸ | CASP9 | P55211 | 1/20 | 0.77 |
| ▸ | CASP6 | P55212 | 1/20 | 0.77 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.77 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.77 |
| ▸ | AHR | P35869 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29580380 | 0.88 | TDP2 (1.00) | TDP2CASP3CASP7CASP9CASP6 | |
| SCHEMBL422023 | 0.88 | TDP2 (1.00) | TDP2CASP3CASP7CASP9CASP6 | |
| Hydrochloric Acid SCHEMBL7001639 | 0.86 | TDP2 (0.96) | TDP2CASP3CASP7CASP9CASP6 | |
| Acetic Acid SCHEMBL9394441 | 0.85 | TDP2 (0.79) | TDP2CASP3CASP7CASP9CASP6 | |
| Hydrochloric Acid SCHEMBL9377496 | 0.84 | TDP2 (0.92) | TDP2CASP3CASP7CASP9CASP6 | |
| Oxindole SCHEMBL10795070 | 0.79 | AHR (0.75) | TDP2CASP3CASP7CASP9CASP6 | |
| SCHEMBL31212786 | 0.78 | TDP2 (0.79) | TDP2CASP3CASP7CASP9CASP6 | |
| Phthalimide SCHEMBL7164645 | 0.78 | GSK3B (0.68) | CASP3CASP7CASP6CASP8MAOA | |
| Phthalimide SCHEMBL217772 | 0.78 | GSK3B (0.68) | CASP3CASP7CASP6CASP8MAOA | |
| Trifluoroacetic Acid SCHEMBL7370043 | 0.78 | TDP2 (0.72) | TDP2CASP3CASP7CASP9CASP6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5854273-A | Bisimide compounds | ADIR ET COMPAGNIE (FR) | 1998-12-29 | — | — | US | disclosed |