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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 7/20 | 0.51 |
| ▸ | TMPRSS15 | P98073 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 6/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | VCAM1 | P19320 | 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 | |
|---|---|---|---|---|
| SCHEMBL7325158 | 0.94 | PRSS1 (0.56) | PRSS1TMPRSS15MEN1KMT2AALDH1A1 | |
| SCHEMBL7328928 | 0.88 | PRSS1 (0.55) | PRSS1TMPRSS15MEN1KMT2AALDH1A1 | |
| SCHEMBL7329001 | 0.83 | PRSS1 (0.59) | PRSS1TMPRSS15KMT2AALDH1A1LMNA | |
| SCHEMBL4005710 | 0.83 | MAPT (0.53) | MEN1KMT2AALDH1A1LMNAGAA | |
| Hydrochloric Acid SCHEMBL7865524 | 0.82 | MAPT (0.52) | PRSS1MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL7330416 | 0.80 | PRSS1 (0.61) | PRSS1TMPRSS15KMT2AALDH1A1LMNA | |
| SCHEMBL7330969 | 0.79 | FTO (0.42) | PRSS1TMPRSS15MEN1KMT2AALDH1A1 | |
| SCHEMBL11217581 | 0.79 | FTO (0.42) | PRSS1TMPRSS15MEN1KMT2AALDH1A1 | |
| SCHEMBL7320813 | 0.78 | PRSS1 (0.53) | PRSS1TMPRSS15MEN1KMT2AALDH1A1 | |
| Nafamostat SCHEMBL1568755 | 0.77 | FTO (0.70) | PRSS1ALDH1A1LMNAMAPTFTO |
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 |
|---|---|---|---|---|---|---|---|
| US-4570006-A | ANTITHROMBIN; ENZYME AND HORMONE INHIBITORS | TORII & CO. LTD. (JP) | 1986-02-11 | — | — | US | disclosed |
| US-4514416-A | Amidine compound, process for producing same and anti-complement agent comprising same | TORII & CO. LTD. (JP) | 1985-04-30 | — | — | US | disclosed |