Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | F2 | P00734 | 2/20 | 0.50 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.50 |
| ▸ | TACR1 | P25103 | 1/20 | 0.50 |
| ▸ | KIF11 | P52732 | 1/20 | 0.49 |
| ▸ | MME | P08473 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
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 SCHEMBL2396342 | 0.88 | ALDH1A1 (0.56) | MMP8ALDH1A1CYP3A4OPRK1MME | |
| Trifluoroacetic Acid SCHEMBL10425462 | 0.85 | ALDH1A1 (0.53) | MMP8ALDH1A1CYP3A4F2TMPRSS6 | |
| Trifluoroacetic Acid SCHEMBL7103734 | 0.84 | MLYCD (0.54) | TACR1KMT2AHDAC3HDAC4HDAC1 | |
| Trifluoroacetic Acid SCHEMBL17106974 | 0.84 | LAP3 (0.60) | MMP8ALDH1A1CYP3A4F2TMPRSS6 | |
| Trifluoroacetic Acid SCHEMBL17106970 | 0.84 | LAP3 (0.60) | MMP8ALDH1A1CYP3A4F2TMPRSS6 | |
| Trifluoroacetic Acid SCHEMBL3587833 | 0.84 | MMP2 (0.52) | MMP8ALDH1A1CYP3A4F2TMPRSS6 | |
| Trifluoroacetic Acid SCHEMBL14762492 | 0.84 | ALDH1A1 (0.56) | MMP8ALDH1A1CYP3A4F2TMPRSS6 | |
| Trifluoroacetic Acid SCHEMBL7101439 | 0.82 | CYP2D6 (0.60) | MMP8TACR1KMT2ACYP2D6CYP2C9 | |
| Trifluoroacetic Acid SCHEMBL31151115 | 0.82 | SLC1A1 (0.57) | MMP8ALDH1A1CYP3A4OPRK1KMT2A | |
| Trifluoroacetic Acid SCHEMBL10424902 | 0.81 | SPHK1 (0.54) | ALDH1A1CYP3A4OPRK1 |
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-1140818-B1 | AMIDOMALONAMIDES AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEINASE | AVENTIS PHARMA INC (US) | 2003-09-10 | — | — | EP | disclosed |
| US-6329550-B1 | FOR THERAPY OF EMPHYSEMA, OSTEOPOROSIS, RHEUMATOID ARTHRITIS AND NEOPLASTIC DISEASES | AVENTIS PHARMACEUTICALS INC. | 2001-12-11 | — | — | US | disclosed |
| EP-1140818-A1 | AMIDOMALONAMIDES AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEINASE | Aventis Pharmaceuticals Inc. (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000040552-A1 | AMIDOMALONAMIDES AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEINASE | AVENTIS PHARMACEUTICALS INC. (US) | 2000-07-13 | — | — | WO | disclosed |