Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | ENPP2 | Q13822 | 15/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL542707 | 0.86 | ENPP2 (0.56) | NPSR1ENPP2ATXN2 | |
| SCHEMBL149388 | 0.84 | ENPP2 (0.55) | NPSR1ENPP2ATXN2 | |
| Hydrochloric Acid SCHEMBL28168579 | 0.83 | ENPP2 (0.54) | NPSR1ENPP2ATXN2 | |
| SCHEMBL25208544 | 0.82 | ENPP2 (0.53) | ENPP2ATXN2 | |
| SCHEMBL171688 | 0.82 | ENPP2 (0.53) | ENPP2ATXN2 | |
| Hydrochloric Acid SCHEMBL34463580 | 0.81 | ENPP2 (0.52) | ENPP2ATXN2 | |
| SCHEMBL25244326 | 0.81 | ENPP2 (0.61) | ENPP2 | |
| SCHEMBL25214041 | 0.79 | ENPP2 (0.60) | ENPP2 | |
| SCHEMBL10102919 | 0.79 | ENPP2 (0.60) | ENPP2 | |
| SCHEMBL1314501 | 0.79 | MEN1 (0.59) | MEN1KMT2ANPSR1TSHRSMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104968656-B | autotaxin inhibitors | 诺华股份有限公司 | 2017-08-11 | — | — | CN | disclosed |
| EP-1390034-A4 | N-SUBSTITUTED NONARYL-HETEROCYCLO AMIDYL NMDA/NR2B ANTAGONISTS | MERCK & CO INC (US) | 2005-07-13 | — | — | EP | disclosed |
| EP-1390034-A1 | N-SUBSTITUTED NONARYL-HETEROCYCLO AMIDYL NMDA/NR2B ANTAGONISTS | Merck & Co., Inc. (US) | 2004-02-25 | — | — | EP | disclosed |
| WO-2002080928-A1 | N-SUBSTITUTED NONARYL-HETEROCYCLO AMIDYL NMDA/NR2B ANTAGONISTS | MERCK & CO., INC. (US) | 2002-10-17 | — | — | WO | disclosed |