Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7723727 | 1.00 | KDM4E (0.33) | KDM4EFFAR3ATMALDH1A1TDP1 | |
| SCHEMBL7731866 | 0.83 | HDAC3 (0.37) | KDM4EFFAR3ATMALDH1A1TSHR | |
| SCHEMBL5143662 | 0.83 | HDAC3 (0.37) | KDM4EFFAR3ATMALDH1A1TSHR | |
| SCHEMBL27832794 | 0.78 | HCAR2 (0.37) | ALDH1A1TDP1TSHRCRBN | |
| SCHEMBL11429636 | 0.78 | — | — | |
| SCHEMBL5188274 | 0.78 | KMT2A (0.45) | KDM4EALDH1A1TDP1TSHR | |
| SCHEMBL5188277 | 0.78 | KMT2A (0.45) | KDM4EALDH1A1TDP1TSHR | |
| SCHEMBL15547189 | 0.77 | KDM4E (0.30) | KDM4ETSHR | |
| SCHEMBL7733322 | 0.77 | ALDH1A1 (0.39) | KDM4EATMALDH1A1TDP1TSHR | |
| SCHEMBL7733319 | 0.77 | ALDH1A1 (0.39) | KDM4EATMALDH1A1TDP1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6399787-B1 | TRANSITION METAL COMPLEX | PENN STATE RESEARCH FOUNDATION | 2002-06-04 | — | — | US | disclosed |
| WO-1999059721-A1 | CATALYTIC ASYMMETRIC HYDROGENATION, HYDROFORMYLATION, AND HYDROVINYLATION VIA TRANSITION METAL CATALYSTS WITH PHOSPHINES AND PHOSPHITES | THE PENN STATE RESEARCH FOUNDATION (US) | 1999-11-25 | — | — | WO | disclosed |