Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FUCA1 | P04066 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.47 |
| ▸ | FAAH | O00519 | 8/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 5/20 | 0.42 |
| ▸ | CES2 | O00748 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.39 |
| ▸ | S1PR2 | O95136 | 3/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL28778451 | 0.92 | EPHX1 (0.60) | EPHX1FAAHCES1CES2MEN1 | |
| Trifluoroacetic Acid SCHEMBL27176216 | 0.86 | EPHX1 (0.41) | FUCA1EPHX1FAAHCES1CES2 | |
| Trifluoroacetic Acid SCHEMBL3928477 | 0.84 | FUCA1 (0.49) | FUCA1EPHX1FAAHALOX15CES1 | |
| Trifluoroacetic Acid SCHEMBL8529050 | 0.83 | FUCA1 (0.47) | FUCA1EPHX1FAAHALOX15CES1 | |
| Acetic Acid SCHEMBL9498328 | 0.81 | EPHX1 (0.55) | EPHX1ALOX15S1PR1S1PR3S1PR2 | |
| Oxalic Acid SCHEMBL28276534 | 0.81 | ALOX15 (0.62) | EPHX1ALOX15S1PR1S1PR3S1PR2 | |
| Trifluoroacetic Acid SCHEMBL29581339 | 0.81 | FAAH (0.54) | EPHX1FAAHCES1CES2MEN1 | |
| Trifluoroacetic Acid SCHEMBL3273685 | 0.81 | FAAH (0.61) | EPHX1FAAHCES1CES2MEN1 | |
| Trifluoroacetic Acid SCHEMBL7710932 | 0.81 | TSHR (0.58) | FUCA1EPHX1FAAHALOX15CES1 | |
| Carbamic Acid SCHEMBL28983310 | 0.79 | ALOX15 (0.54) | EPHX1ALOX15S1PR1S1PR3S1PR2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0739886-B1 | Selective thrombin inhibitors | LG CHEMICAL LTD (KR) | 2003-10-01 | — | — | EP | disclosed |
| CN-1103333-C | Selective thrombin inhibitors | LG CHEMICAL LTD (KR) | 2003-03-19 | — | — | CN | disclosed |
| US-5985899-A | ANTICOAGULANTS | LG CHEMICAL LTD. (KR) | 1999-11-16 | — | — | US | disclosed |
| US-5977114-A | Selective thrombin inhibitors | LG CHEMICAL LTD. (KR) | 1999-11-02 | — | — | US | disclosed |
| CN-1183766-A | Selective thrombin inhibitors | LG CHEMICAL LTD (KR) | 1998-06-03 | — | — | CN | disclosed |
| US-5747535-A | AMIDINOPHENYL COMPOUNDS | LG CHEMICAL LTD. (KR) | 1998-05-05 | — | — | US | disclosed |
| WO-1997049673-A1 | SELECTIVE THROMBIN INHIBITORS | LG CHEMICAL LTD. (KR) | 1997-12-31 | — | — | WO | disclosed |
| EP-0739886-A2 | Selective thrombin inhibitors | LG Chemical Limited (KR) | 1996-10-30 | — | — | EP | disclosed |