Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | THPO | P40225 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3786186 | 1.00 | KDM4E (0.52) | KDM4ESMN1; SMN2MAPTTHRBALOX15 | |
| SCHEMBL3787753 | 1.00 | KDM4E (0.52) | KDM4ESMN1; SMN2MAPTTHRBALOX15 | |
| SCHEMBL12052273 | 0.85 | SMN1; SMN2 (0.52) | KDM4ESMN1; SMN2MAPTTHRBALOX15 | |
| SCHEMBL203913 | 0.81 | TGFBR1 (0.41) | KDM4EKMT2AALDH1A1TSHRGAA | |
| SCHEMBL2708048 | 0.81 | TGFBR1 (0.41) | KDM4EKMT2AALDH1A1TSHRGAA | |
| SCHEMBL2707933 | 0.81 | TGFBR1 (0.41) | KDM4EKMT2AALDH1A1TSHRGAA | |
| SCHEMBL12537175 | 0.81 | TSHR (0.50) | KDM4ESMN1; SMN2MAPTTHRBALOX15 | |
| SCHEMBL10076100 | 0.81 | NOD1 (0.45) | KMT2AALDH1A1TSHRPLA2G2CFOLH1 | |
| SCHEMBL11107976 | 0.80 | PMP22 (0.38) | KDM4EKMT2AALDH1A1TSHRGAA | |
| SCHEMBL468726 | 0.79 | MAPT (0.59) | KDM4ESMN1; SMN2MAPTTHRBALOX15 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1585730-B1 | CARBOXAMIDE DERIVATIVES AND THEIR USE AS FACTOR XA INHIBITORS | MERCK PATENT GMBH (DE) | 2011-03-09 | — | — | EP | disclosed |
| EP-0744948-A4 | PROTEASE INHIBITORS | LILLY CO ELI (US) | 1997-06-11 | — | — | EP | disclosed |
| US-5624934-A | PREVENTING HIV INFECTION | ELI LILLY AND COMPANY (US) | 1997-04-29 | — | — | US | disclosed |
| EP-0744948-A1 | PROTEASE INHIBITORS | ELI LILLY AND COMPANY (US) | 1996-12-04 | — | — | EP | disclosed |
| WO-1995020962-A1 | PROTEASE INHIBITORS | ELI LILLY AND COMPANY (US) | 1995-08-10 | — | — | WO | disclosed |