Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | P2RX1 | P51575 | 2/20 | 0.31 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.31 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | APEX1 | P27695 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1535816 | 0.84 | CA12 (0.52) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL578778 | 0.79 | P2RX4 (0.31) | TP53P2RX1P2RX4P2RX3BCHE | |
| SCHEMBL6195760 | 0.75 | — | — | |
| SCHEMBL24024135 | 0.75 | CA12 (0.36) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL10988112 | 0.72 | CA12 (0.47) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL10901655 | 0.72 | CA12 (0.41) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL25007406 | 0.71 | CA12 (0.34) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL20740822 | 0.71 | ALDH1A1 (0.44) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL3065351 | 0.70 | CA12 (0.56) | CA12CA2CA9TSHRALDH1A1 | |
| S-Ethyl Dipropylcarbamothioate SCHEMBL10793164 | 0.69 | TSHR (0.80) | CA12CA2CA9TSHRMAPK1 |
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-2003060191-A2 | NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT | UNIVERSITY OF DAYTON (US) | 2003-07-24 | — | — | WO | disclosed |