Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7701971 | 0.80 | MEN1 (0.45) | SMN1; SMN2TSHRMAPTNPC1KMT2A | |
| SCHEMBL6186894 | 0.75 | SMN1; SMN2 (0.55) | SMN1; SMN2TSHRMAPTNPC1KMT2A | |
| SCHEMBL6988214 | 0.73 | GAK (0.49) | SMN1; SMN2MAPTNPC1KMT2AHTT | |
| SCHEMBL11195433 | 0.72 | KMT2A (0.80) | SMN1; SMN2TSHRMAPTNPC1KMT2A | |
| SCHEMBL6990762 | 0.72 | ALDH1A1 (0.56) | SMN1; SMN2MAPTNPC1KMT2AHTT | |
| SCHEMBL6986415 | 0.71 | RAB9A (0.52) | SMN1; SMN2MAPTNPC1KMT2AHTT | |
| SCHEMBL1971026 | 0.70 | NAMPT (0.78) | SMN1; SMN2MAPTNPC1KMT2AHTT | |
| SCHEMBL21870191 | 0.70 | MAPT (0.66) | SMN1; SMN2TSHRMAPTKDM4ERAB9A | |
| SCHEMBL14880158 | 0.70 | RAB9A (0.70) | SMN1; SMN2TSHRMAPTNPC1KMT2A | |
| SCHEMBL14339876 | 0.69 | SMN1; SMN2 (0.64) | SMN1; SMN2TSHRMAPTNPC1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1303508-A1 | SUBSTITUTED 1-(4-AMINOPHENYL)INDOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | Boehringer Ingelheim Pharmaceuticals, Inc. (US) | 2003-04-23 | — | — | EP | disclosed |
| WO-2002006273-A1 | SUBSTITUTED 1-(4-AMINOPHENYL)INDOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2002-01-24 | — | — | WO | disclosed |