Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 8/20 | 0.36 |
| ▸ | CA1 | P00915 | 7/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | DNM1 | Q05193 | 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 | |
|---|---|---|---|---|
| SCHEMBL11370676 | 0.95 | TSHR (0.39) | TSHRBLMPMP22HSD17B10KDM4E | |
| SCHEMBL11367273 | 0.87 | BLM (0.53) | TSHRBLMPMP22HSD17B10KDM4E | |
| SCHEMBL29415364 | 0.87 | TSHR (0.41) | TSHRBLMPMP22HSD17B10KDM4E | |
| SCHEMBL11367249 | 0.81 | BLM (0.47) | TSHRBLMPMP22HSD17B10KDM4E | |
| SCHEMBL19057647 | 0.80 | BLM (0.40) | TSHRBLMPMP22HSD17B10KDM4E | |
| Malonic Acid SCHEMBL3706228 | 0.79 | BLM (0.55) | BLMPMP22HSD17B10KDM4ECA2 | |
| SCHEMBL17762997 | 0.79 | ECE1 (0.42) | TSHRBLMPMP22KDM4ELMNA | |
| SCHEMBL19658212 | 0.78 | TSHR (0.41) | TSHRBLMPMP22HSD17B10KDM4E | |
| SCHEMBL28359699 | 0.78 | DNM1 (0.55) | KDM4ECNR1DNM1 | |
| SCHEMBL20521372 | 0.78 | DNM1 (0.51) | KDM4EMEN1KMT2ACNR1DNM1 |
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-8222449-B2 | Metal oxide-chelating ligands | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2012-07-17 | — | — | US | disclosed |