Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 2/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
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 SCHEMBL7566926 | 0.98 | NPC1 (0.32) | NPC1CASP3RAB9ASMN1; SMN2SENP8 | |
| SCHEMBL9065916 | 0.79 | CA1 (0.35) | TSHR | |
| SCHEMBL9066114 | 0.77 | CYP2D6 (0.36) | TSHR | |
| Hydrochloric Acid SCHEMBL7566172 | 0.77 | CA1 (0.34) | TSHR | |
| Hydrochloric Acid SCHEMBL7567523 | 0.76 | CYP2D6 (0.35) | — | |
| SCHEMBL8759825 | 0.73 | NPC1 (0.32) | NPC1CASP3RAB9ASMN1; SMN2SENP8 | |
| Hydrochloric Acid SCHEMBL7566924 | 0.73 | NISCH (0.35) | NPC1CASP3RAB9ASMN1; SMN2SENP8 | |
| SCHEMBL7740532 | 0.72 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL8341746 | 0.72 | CYP1A2 (0.41) | — | |
| Hydrochloric Acid SCHEMBL7526849 | 0.71 | HTR1A (0.32) | NPC1CASP3RAB9ASMN1; SMN2SENP8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0540108-B1 | Catalyst composition | SHELL INT RESEARCH (NL) | 1996-01-03 | — | — | EP | claimed |