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 | |
|---|---|---|---|---|
| ▸ | DRD4 known ✓ | P21917 | 5/20 | 0.51 |
| ▸ | DRD2 known ✓ | P14416 | 2/20 | 0.46 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.46 |
| ▸ | HTR2A known ✓ | P28223 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | F8 | P00451 | 1/20 | 0.47 |
| ▸ | F5 | P12259 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | IDE | P14735 | 1/20 | 0.46 |
| ▸ | XBP1 | P17861 | 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 | |
|---|---|---|---|---|
| SCHEMBL9750861 | 0.89 | KMT2A (0.72) | KMT2AMEN1ATMCYP1A2CYP2D6 | |
| SCHEMBL9750908 | 0.86 | KMT2A (0.45) | KMT2AMEN1ATMCYP1A2CYP2D6 | |
| SCHEMBL9750911 | 0.82 | KMT2A (0.81) | KMT2AMEN1ATMCYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL9751034 | 0.81 | KMT2A (0.80) | KMT2AMEN1ATMCYP1A2CYP2D6 | |
| SCHEMBL9750864 | 0.75 | KMT2A (0.56) | KMT2AMEN1ATMDRD4ABCB1 | |
| SCHEMBL18177902 | 0.75 | CYP2D6 (0.73) | KMT2AMEN1ATMCYP1A2CYP2D6 | |
| SCHEMBL6213878 | 0.74 | ABCB11 (0.54) | KMT2AMEN1ATMCYP1A2CYP2D6 | |
| SCHEMBL6214273 | 0.72 | ABCB11 (0.66) | KMT2AMEN1ATMDRD4ABCB1 | |
| SCHEMBL6214267 | 0.72 | ABCB11 (0.66) | KMT2AMEN1ATMDRD4ABCB1 | |
| Hydrochloric Acid SCHEMBL9751006 | 0.72 | DRD4 (0.68) | KMT2AMEN1ATMDRD4ABCB1 |
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-5036077-A | Antiseptics, preservatives, drugs, cosmetics, foods | SANOFI (FR) | 1991-07-30 | — | — | US | disclosed |