Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6071400 | 0.78 | KMT2A (0.48) | ALDH1A1HSD17B10TSHRNOS1CYP1A2 | |
| SCHEMBL3879803 | 0.70 | CYP1A2 (0.54) | ALDH1A1HSD17B10TSHRCYP1A2CYP17A1 | |
| SCHEMBL6087377 | 0.69 | HTR2C (0.47) | LMNA | |
| SCHEMBL4888542 | 0.67 | CYP17A1 (0.50) | ALDH1A1HSD17B10CYP1A2CYP17A1TDP1 | |
| SCHEMBL6087456 | 0.67 | CYP1A2 (0.34) | ALDH1A1HSD17B10CYP1A2LMNAMEN1 | |
| SCHEMBL30061281 | 0.67 | ALDH1A1 (0.40) | ALDH1A1HSD17B10TSHRNOS1CYP1A2 | |
| SCHEMBL28163735 | 0.64 | NR3C2 (0.41) | ALDH1A1HSD17B10TSHRNOS1CYP1A2 | |
| SCHEMBL6087351 | 0.64 | HSP90AA1 (0.40) | TSHRCYP1A2CYP17A1SCN9ANPC1 | |
| SCHEMBL6071763 | 0.64 | GSK3B (0.51) | ALDH1A1HSD17B10TSHRCYP1A2CYP17A1 | |
| SCHEMBL7232953 | 0.64 | MAPK1 (0.51) | ALDH1A1CYP1A2CYP17A1TDP1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009140451-A1 | KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING SAID COMPOUNDS, AND USE THEREOF | THE PROCTER & GAMBLE COMPANY (US) | 2009-11-19 | — | — | WO | disclosed |