Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 5/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MIF | P14174 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.37 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.37 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6686566 | 0.77 | TSHR (0.52) | ALDH1A1TSHRIDO1 | |
| SCHEMBL3073562 | 0.75 | TSHR (0.42) | FDPSHPGDTSHRCA12CA1 | |
| SCHEMBL6686557 | 0.71 | IDO1 (0.38) | GRIN2BGRIN1FDPSNOS2HPGD | |
| SCHEMBL6682554 | 0.71 | TSHR (0.55) | ALDH1A1TSHRIDO1 | |
| SCHEMBL9348508 | 0.70 | ALDH1A1 (0.41) | GRIN2BGRIN1NOS2HPGDTRPA1 | |
| SCHEMBL3070712 | 0.70 | TSHR (0.44) | FDPSHPGDTSHRCA12CA1 | |
| SCHEMBL1653 | 0.68 | ALDH1A1 (0.55) | GRIN2BGRIN1NOS2HPGDTRPA1 | |
| SCHEMBL453564 | 0.67 | — | — | |
| SCHEMBL8371905 | 0.67 | TSHR (0.57) | FDPSHPGDTSHRCA12CA1 | |
| SCHEMBL6310521 | 0.67 | HPGD (0.58) | FDPSHPGDTSHRCA12CA1 |
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-2003060192-A1 | NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT | UNIVERSITY OF DAYTON (US) | 2003-07-24 | — | — | WO | disclosed |