Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | REN | P00797 | 2/20 | 0.37 |
| ▸ | CRAT | P43155 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MME | P08473 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KISS1R | Q969F8 | 1/20 | 0.33 |
| ▸ | MLYCD | O95822 | 1/20 | 0.33 |
| ▸ | PLA2G10 | O15496 | 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 | |
|---|---|---|---|---|
| SCHEMBL11311284 | 0.86 | MGAM (0.44) | ALDH1A1CRATMGAMGAASI | |
| SCHEMBL11315545 | 0.85 | CRAT (0.37) | ALDH1A1RENCRATMGAMGAA | |
| SCHEMBL4156137 | 0.84 | CNR2 (0.42) | ALDH1A1MGAMGAASIMGAM2 | |
| SCHEMBL4241379 | 0.83 | PLA2G10 (0.38) | RENMGAMGAASIMGAM2 | |
| SCHEMBL7731861 | 0.80 | ALDH1A1 (0.53) | ALDH1A1CRATMMETDP1PLA2G10 | |
| SCHEMBL1405643 | 0.80 | CA12 (0.41) | CRATMGAMGAASIMGAM2 | |
| SCHEMBL20144715 | 0.78 | ALDH1A1 (0.47) | ALDH1A1CA12CA7CA9CA14 | |
| SCHEMBL24387611 | 0.78 | CA1 (0.49) | RENCA7MLYCD | |
| SCHEMBL2739507 | 0.76 | DPP4 (0.37) | RENMMP1 | |
| SCHEMBL1144293 | 0.75 | MGAM (0.42) | ALDH1A1MGAMGAASIMGAM2 |
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 |