Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EED | O75530 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | GRIN2D | O15399 | 8/20 | 0.44 |
| ▸ | GRIN3B | O60391 | 8/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 8/20 | 0.44 |
| ▸ | GRIN2A | Q12879 | 8/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 8/20 | 0.44 |
| ▸ | GRIN2C | Q14957 | 8/20 | 0.44 |
| ▸ | GRIN3A | Q8TCU5 | 8/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.43 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.40 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8675065 | 0.76 | CYP1A2 (0.65) | CYP1A2TSHRADRA1ANISCH | |
| SCHEMBL9868972 | 0.74 | ROCK1 (0.47) | CYP1A2TSHR | |
| SCHEMBL5827304 | 0.71 | GRIN2D (0.44) | EEDCYP1A2TSHRGRIN2DGRIN3B | |
| SCHEMBL9619232 | 0.68 | NISCH (0.58) | ADRA1DADRA1AADRA1BNISCH | |
| SCHEMBL21017285 | 0.67 | TSHR (0.31) | CYP1A2TSHRCHRM1ADRA1DADRA1A | |
| SCHEMBL21017772 | 0.65 | TAAR1 (0.32) | CYP1A2TSHRADRA1DADRA1AADRA1B | |
| SCHEMBL11418621 | 0.65 | NISCH (0.55) | ADRA1DADRA1AADRA1BNISCH | |
| SCHEMBL563657 | 0.65 | GRIN2D (0.69) | EEDGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL5827949 | 0.64 | MEN1 (0.46) | CYP1A2TSHRGRIN1GRIN2B | |
| SCHEMBL21017746 | 0.64 | HTT (0.31) | NISCH |
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-3835142-A | 1-(2-IMIDAZOLIN-2-YL)-2-(1,2,3,4-TETRAHYDRO-2-ISOQUINOLYL)-2-IMIDAZOLINES | WARNER LAMBERT CO | 1974-09-10 | — | — | US | disclosed |