Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.54 |
| ▸ | HTR1D | P28221 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | HTR7 | P34969 | 1/20 | 0.54 |
| ▸ | HTR3A | P46098 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | RAD52 | P43351 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1424220 | 0.82 | ALDH1A1 (0.69) | HTR6HTR1DCYP3A4MAPK1CYP1A2 | |
| SCHEMBL29415611 | 0.82 | ALDH1A1 (0.69) | HTR6HTR1DCYP3A4MAPK1CYP1A2 | |
| Hydrochloric Acid SCHEMBL273338 | 0.80 | ALDH1A1 (0.67) | HTR6HTR1DCYP3A4MAPK1CYP1A2 | |
| Cyanide SCHEMBL28575462 | 0.78 | ALDH1A1 (0.63) | HTR6HTR1DCYP3A4MAPK1CYP1A2 | |
| Oxalic Acid SCHEMBL27171318 | 0.74 | MAPT (0.63) | HTR6HTR1DCYP3A4MAPK1CYP1A2 | |
| SCHEMBL7886752 | 0.72 | HTR1D (0.71) | HTR6HTR1DCYP3A4MAPK1CYP1A2 | |
| Indole SCHEMBL28334991 | 0.71 | ALDH1A1 (0.54) | HTR6HTR1DCYP3A4MAPK1CYP1A2 | |
| SCHEMBL28750432 | 0.70 | HTR6 (0.68) | HTR6HTR1DCYP3A4MAPK1CYP1A2 | |
| SCHEMBL30619662 | 0.70 | HTR6 (0.68) | HTR6HTR1DCYP3A4MAPK1CYP1A2 | |
| SCHEMBL8244089 | 0.70 | HTR6 (0.68) | HTR6HTR1DCYP3A4MAPK1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0233413-B1 | 3-(2-AMINOETHYL)INDOLE AND -INDOLINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SMITHKLINE BEECHAM PHARMA GmbH (DE) | 1993-05-05 | — | — | EP | disclosed |
| US-4980368-A | CEREBRALVASCULAR DISORDERS; ANTIHYPOXIA AGENTS; COGNITION ACTIVATORS; SENILITY | BEECHAM-WUELFING GMBH & CO. KG (DE) | 1990-12-25 | — | — | US | disclosed |
| EP-0233413-A2 | 3-(2-Aminoethyl)indole and -indoline derivatives, processes for their preparation and pharmaceutical compositions containing them | SMITHKLINE BEECHAM PHARMA GmbH (DE) | 1987-08-26 | — | — | EP | disclosed |