Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of 1,2-Dichlorobenzene. 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 | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 8/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.64 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.64 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | SIGMAR1 | Q99720 | 11/20 | 0.61 |
| ▸ | TSHR | P16473 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | MTOR | P42345 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.55 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.55 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL10385256 | 0.82 | SIGMAR1 (0.57) | OPRK1CYP3A4CYP2D6SIGMAR1TSHR | |
| SCHEMBL10385255 | 0.82 | SIGMAR1 (0.57) | OPRK1CYP3A4CYP2D6SIGMAR1TSHR | |
| U-50488 Methane Sulfonate SCHEMBL3174432 | 0.78 | OPRK1 (1.00) | OPRK1CYP3A4CYP2D6PMP22NFKB1 | |
| U-50488 Methane Sulfonate SCHEMBL548872 | 0.78 | OPRK1 (1.00) | OPRK1CYP3A4CYP2D6PMP22NFKB1 | |
| (-)-U-50488 SCHEMBL31607484 | 0.78 | OPRK1 (1.00) | OPRK1CYP3A4CYP2D6PMP22NFKB1 | |
| U-50488 Methane Sulfonate SCHEMBL29878872 | 0.78 | OPRK1 (1.00) | OPRK1CYP3A4CYP2D6PMP22NFKB1 | |
| U-50488 Methane Sulfonate SCHEMBL29412563 | 0.78 | OPRK1 (1.00) | OPRK1CYP3A4CYP2D6PMP22NFKB1 | |
| U-50488 Methane Sulfonate SCHEMBL2274248 | 0.77 | OPRK1 (0.98) | OPRK1CYP3A4CYP2D6PMP22NFKB1 | |
| U-50488 Methane Sulfonate SCHEMBL2274253 | 0.77 | OPRK1 (0.98) | OPRK1CYP3A4CYP2D6PMP22NFKB1 | |
| SCHEMBL9699899 | 0.75 | SIGMAR1 (0.67) | OPRK1CYP3A4CYP2D6PMP22SIGMAR1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1212000-B1 | SYSTEM FOR CONTROLLING BODY TEMPERATURE WHILE REDUCING SHIVERING | RADIANT MEDICAL INC (US) | 2006-01-04 | — | — | EP | disclosed |
| US-6572638-B1 | Method of controlling body temperature while inhibiting thermoregulatory responses | RADIANT MEDICAL, INC. | 2003-06-03 | — | — | US | disclosed |
| EP-1212000-A4 | METHOD OF CONTROLLING BODY TEMPERATURE WHILE REDUCING SHIVERING | RADIANT MEDICAL INC (US) | 2002-10-25 | — | — | EP | disclosed |
| EP-1212000-A1 | SYSTEM FOR CONTROLLING BODY TEMPERATURE WHILE REDUCING SHIVERING | Radiant Medical, Inc. (US) | 2002-06-12 | — | — | EP | disclosed |
| WO-2001010323-A1 | METHOD OF CONTROLLING BODY TEMPERATURE WHILE REDUCING SHIVERING | RADIANT MEDICAL, INC. (US) | 2001-02-15 | — | — | WO | disclosed |