Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MPI | P34949 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7425901 | 0.86 | KDM4E (0.47) | KDM4ESMN1; SMN2ALDH1A1HPGDTDP1 | |
| Hydrochloric Acid SCHEMBL5849581 | 0.83 | MTNR1A (0.52) | KDM4EALDH1A1MAPTMAPK1CYP1A2 | |
| Hydrochloric Acid SCHEMBL5849580 | 0.83 | MTNR1A (0.52) | KDM4EALDH1A1MAPTMAPK1CYP1A2 | |
| Hydrochloric Acid SCHEMBL6531864 | 0.83 | MTNR1A (0.52) | KDM4EALDH1A1MAPTMAPK1CYP1A2 | |
| SCHEMBL30358033 | 0.81 | MTNR1A (0.53) | KDM4EALDH1A1MAPTGAAMTNR1A | |
| SCHEMBL428189 | 0.81 | MTNR1A (0.53) | KDM4EALDH1A1MAPTGAAMTNR1A | |
| SCHEMBL5849585 | 0.81 | MTNR1A (0.53) | KDM4EALDH1A1MAPTGAAMTNR1A | |
| SCHEMBL22800174 | 0.77 | KDM4E (0.44) | KDM4ESMN1; SMN2ALDH1A1MAPTMAPK1 | |
| SCHEMBL22800767 | 0.77 | KDM4E (0.44) | KDM4ESMN1; SMN2ALDH1A1MAPTMAPK1 | |
| SCHEMBL7435456 | 0.76 | KDM4E (0.49) | KDM4EALDH1A1HPGDMAPTMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0670310-B1 | Bisulfite adducts of arginine aldehydes useful as thrombin inhibitors and as anticoagulants | LILLY CO ELI (US) | 1998-09-02 | — | — | EP | disclosed |
| US-5578574-A | THROMBIN INHIBITORS OR ANTICOAGULANTS | ELI LILLY AND COMPANY (US) | 1996-11-26 | — | — | US | disclosed |
| EP-0672665-A1 | Antithrombotic agents | ELI LILLY AND COMPANY (US) | 1995-09-20 | — | — | EP | disclosed |
| EP-0670310-A1 | Bisulfite adducts of arginine aldehydes useful as thrombin inhibitors and as anticoagulants | ELI LILLY AND COMPANY (US) | 1995-09-06 | — | — | EP | disclosed |