Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SI | P14410 | 1/20 | 0.41 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.41 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | POLA1 | P09884 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | FNTA | P49354 | 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 | |
|---|---|---|---|---|
| SCHEMBL31563652 | 1.00 | TSHR (0.41) | TSHRKDM4EMGAMGAASI | |
| SCHEMBL5472413 | 0.84 | TSHR (0.60) | TSHRKDM4EMGAMGAASI | |
| SCHEMBL15741505 | 0.84 | TSHR (0.60) | TSHRKDM4EMGAMGAASI | |
| SCHEMBL15741484 | 0.84 | TSHR (0.60) | TSHRKDM4ETET2HSD17B10EGLN1 | |
| SCHEMBL2926536 | 0.84 | TSHR (0.60) | TSHRKDM4ETET2HSD17B10EGLN1 | |
| SCHEMBL10259507 | 0.84 | TSHR (0.60) | TSHRKDM4EMGAMGAASI | |
| SCHEMBL2926538 | 0.84 | TSHR (0.60) | TSHRKDM4ETET2HSD17B10EGLN1 | |
| SCHEMBL10000423 | 0.83 | MGAM (0.41) | TSHRMGAMGAASIMGAM2 | |
| SCHEMBL12332891 | 0.83 | MGAM (0.41) | TSHRMGAMGAASIMGAM2 | |
| SCHEMBL7767062 | 0.80 | KDM4E (0.43) | TSHRKDM4ETET2EGLN1HCAR2 |
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-20170191089-A1 | ITACONIC ACID AND ITACONATE METHYLESTER AND DIMETHYLESTER PRODUCTION | DSM IP ASSETS B.V. (NL) | 2017-07-06 | — | — | US | disclosed |