Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.46 |
| ▸ | RXRB | P28702 | 1/20 | 0.46 |
| ▸ | RXRG | P48443 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RBP4 | P02753 | 5/20 | 0.41 |
| ▸ | ELANE | P08246 | 2/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14924836 | 0.83 | TDP1 (0.53) | TDP1ATMKDM4EALDH1A1GAA | |
| SCHEMBL7854576 | 0.81 | L3MBTL1 (0.40) | KDM4ENPSR1ELANEMEN1MAPT | |
| SCHEMBL453104 | 0.77 | ELANE (0.46) | TDP1ATMELANEMAPTALOX15 | |
| SCHEMBL28008264 | 0.77 | ELANE (0.51) | TDP1ATMKDM4EALDH1A1GAA | |
| SCHEMBL31304747 | 0.77 | TDP1 (0.65) | TDP1ATMKDM4EALDH1A1GAA | |
| SCHEMBL47808 | 0.77 | TDP1 (0.65) | TDP1ATMKDM4EALDH1A1GAA | |
| SCHEMBL6851496 | 0.76 | TDP1 (0.55) | TDP1ATMKDM4EALDH1A1GAA | |
| SCHEMBL1791077 | 0.76 | TDP1 (0.55) | TDP1ATMKDM4EALDH1A1GAA | |
| SCHEMBL30201392 | 0.76 | TDP1 (0.55) | TDP1ATMKDM4EALDH1A1GAA | |
| SCHEMBL47807 | 0.75 | TDP1 (0.62) | TDP1ATMKDM4EALDH1A1GAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1354887-B1 | Ligands for metals and improved metal-catalyzed processes based thereon | MASSACHUSETTS INST TECHNOLOGY (US) | 2007-04-25 | — | — | EP | disclosed |
| EP-1097158-B1 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INST TECHNOLOGY (US) | 2006-01-25 | — | — | EP | disclosed |
| EP-1354887-A1 | Ligands for metals and improved metal-catalyzed processes based thereon | Massachusetts Insitute of Technology (US) | 2003-10-22 | — | — | EP | disclosed |