Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 4/20 | 0.42 |
| ▸ | TMPRSS6 | Q8IU80 | 4/20 | 0.42 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.41 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.41 |
| ▸ | CLPP | Q16740 | 1/20 | 0.40 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.40 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.39 |
| ▸ | GPR34 | Q9UPC5 | 1/20 | 0.39 |
| ▸ | KLK1 | P06870 | 1/20 | 0.39 |
| ▸ | F11 | P03951 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL8530291 | 0.83 | ERCC1 (0.45) | ERCC1ERCC4FOLH1KLKB1GPR34 | |
| Trifluoroacetic Acid SCHEMBL8146359 | 0.79 | FEN1 (0.39) | FOLH1KLKB1GPR34KLK1F11 | |
| Trifluoroacetic Acid SCHEMBL8137836 | 0.76 | TACR1 (0.41) | KLKB1F11SLC2A1 | |
| SCHEMBL9273671 | 0.75 | GPR34 (0.50) | ERCC1ERCC4FOLH1GPR34FFAR1 | |
| Trifluoroacetic Acid SCHEMBL9287698 | 0.74 | F11 (0.35) | KLKB1GPR34F11CNR2SLC2A1 | |
| SCHEMBL7354256 | 0.73 | EPHX1 (0.46) | ERCC1ERCC4FOLH1 | |
| SCHEMBL7354251 | 0.73 | EPHX1 (0.46) | ERCC1ERCC4FOLH1 | |
| Trifluoroacetic Acid SCHEMBL3488528 | 0.73 | VNN1 (0.48) | ERCC1ERCC4FOLH1SLC2A1FFAR1 | |
| SCHEMBL8843830 | 0.72 | EPHX1 (0.51) | — | |
| SCHEMBL9706212 | 0.72 | EPHX1 (0.51) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6114390-A | AN ARGININAMIDE OR ORNITHINAMIDE COMPOUND AS TREATING MEMORY LOSS, MIGRAINE, SLEEP DISORDERS, PAIN, CARDIOVASCULAR DISEASES, SUBARACHNOIDAL BLEEDING, VASCULAR-HYPERTROPHIC CHANGES, CEREBRAL AND CORONARY VASOSPASMS | KARL THOMAE GMBH (DE) | 2000-09-05 | — | — | US | disclosed |
| EP-0885186-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997019911-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1997-06-05 | — | — | WO | disclosed |