Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 2/20 | 0.56 |
| ▸ | MMP9 | P14780 | 2/20 | 0.56 |
| ▸ | MMP1 | P03956 | 2/20 | 0.51 |
| ▸ | FCER2 | P06734 | 2/20 | 0.51 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | MMP8 | P22894 | 2/20 | 0.48 |
| ▸ | MME | P08473 | 3/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | ANPEP | P15144 | 1/20 | 0.45 |
| ▸ | ECE1 | P42892 | 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 | |
|---|---|---|---|---|
| SCHEMBL7308337 | 0.87 | MMP9 (0.55) | MMP2MMP9MMP1FCER2ADAM17 | |
| SCHEMBL7303001 | 0.84 | MTNR1A (0.54) | MMP2MMP9MMP1MTNR1AMTNR1B | |
| SCHEMBL13103439 | 0.83 | CYP1A2 (0.63) | CYP1A2HDAC1HDAC3HDAC8HDAC6 | |
| SCHEMBL7302563 | 0.79 | MMP2 (0.47) | MMP2MMP9MMP1FCER2ADAM17 | |
| SCHEMBL7392419 | 0.78 | HDAC8 (0.54) | MMP2MMP9MMP1HDAC1HDAC3 | |
| SCHEMBL13103425 | 0.77 | CYP1A2 (0.60) | CYP1A2HDAC1HDAC3HDAC8HDAC6 | |
| SCHEMBL7356639 | 0.77 | HDAC8 (0.56) | MMP2MMP9MMP1HDAC1HDAC3 | |
| SCHEMBL23190984 | 0.74 | MMP2 (0.56) | MMP2MMP9MMP1CYP1A2MMP8 | |
| SCHEMBL6170034 | 0.74 | CYP1A2 (0.53) | CYP1A2 | |
| SCHEMBL6170039 | 0.74 | CYP1A2 (0.53) | CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0780386-B1 | Matrix metalloprotease inhibitors | HOFFMANN LA ROCHE (CH) | 2002-10-02 | — | — | EP | disclosed |
| US-5932595-A | ANTIARTHRITIC AGENT; MULTIPLE SCLEROSIS; OSTEOPOROSIS; RESPIRATORY SYSTEM DISORDERS; SKIN DISORDERS; ANTIULCER AGENT | SYNTEX (U.S.A.) INC. (US) | 1999-08-03 | — | — | US | disclosed |
| EP-0780386-A1 | Matrix metalloprotease inhibitors | F. HOFFMANN-LA ROCHE AG (CH) | 1997-06-25 | — | — | EP | disclosed |