Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | VNN1 | O95497 | 10/20 | 0.38 |
| ▸ | HPGDS | O60760 | 1/20 | 0.37 |
| ▸ | BTD | P43251 | 2/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL16629775 | 1.00 | KDM4E (0.39) | KDM4EALDH1A1SMN1; SMN2VNN1HPGDS | |
| Ammonia Solution, Strong SCHEMBL16619952 | 0.98 | KDM4E (0.38) | KDM4EALDH1A1SMN1; SMN2VNN1HPGDS | |
| SCHEMBL469175 | 0.78 | SMN1; SMN2 (0.40) | KDM4EALDH1A1SMN1; SMN2VNN1HPGDS | |
| SCHEMBL16619262 | 0.77 | HSP90AA1 (0.38) | KDM4EALDH1A1SMN1; SMN2HSP90AA1LMNA | |
| SCHEMBL29738290 | 0.77 | — | — | |
| SCHEMBL681871 | 0.77 | — | — | |
| SCHEMBL25967075 | 0.76 | VNN1 (0.38) | KDM4EALDH1A1SMN1; SMN2VNN1HPGDS | |
| SCHEMBL19779425 | 0.76 | ALDH1A1 (0.39) | KDM4EALDH1A1SMN1; SMN2VNN1HPGDS | |
| SCHEMBL19324243 | 0.75 | HPGDS (0.47) | VNN1HPGDSBTDLMNA | |
| SCHEMBL12812605 | 0.75 | SMN1; SMN2 (0.38) | KDM4EALDH1A1SMN1; SMN2VNN1HPGDS |
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-9238647-B2 | P2X3 receptor antagonists for treatment of pain | MERCK SHARP & DOHME CORP. (US) | 2016-01-19 | — | — | US | disclosed |