Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGM2 | P21980 | 1/20 | 0.56 |
| ▸ | GRM5 | P41594 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18415493 | 0.84 | HDAC6 (0.50) | GRM5HDAC6HDAC8THRBHPGD | |
| SCHEMBL18415486 | 0.80 | GRM5 (0.53) | GRM5HDAC6HDAC8THRBHPGD | |
| SCHEMBL732934 | 0.79 | TGM2 (0.81) | TGM2ALDH1A1TDP1TSHRMAPK1 | |
| Thiophene SCHEMBL28891798 | 0.77 | TGM2 (0.57) | TGM2HPGDALDH1A1TSHRLMNA | |
| SCHEMBL9430237 | 0.77 | GRM5 (0.50) | GRM5HDAC6HDAC8THRBHPGD | |
| SCHEMBL26181255 | 0.75 | TGM2 (0.63) | TGM2ALDH1A1TDP1TSHRMAPK1 | |
| SCHEMBL6720904 | 0.75 | GRM5 (0.52) | GRM5HDAC6HDAC8THRBHPGD | |
| SCHEMBL9480522 | 0.75 | THRB (0.49) | GRM5HDAC6HDAC8THRBHPGD | |
| SCHEMBL12990668 | 0.75 | GRM5 (0.46) | GRM5HDAC6HDAC8THRBHPGD | |
| SCHEMBL40744 | 0.74 | TGM2 (0.68) | TGM2HPGDALDH1A1TSHRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1226138-B1 | FAB I INHIBITORS | AFFINIUM PHARM INC (CA) | 2004-12-29 | — | — | EP | disclosed |