Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | LDHA | P00338 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 6/20 | 0.42 |
| ▸ | MMP3 | P08254 | 3/20 | 0.39 |
| ▸ | MMP2 | P08253 | 3/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.39 |
| ▸ | MC4R | P32245 | 2/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.39 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MMP7 | P09237 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL17038560 | 0.87 | SLC6A4 (0.50) | SLC6A4CYP1A2CYP2D6CYP2C19LDHA | |
| SCHEMBL7329603 | 0.82 | SLC6A4 (0.50) | SLC6A4CYP1A2CYP2D6CYP2C19LDHA | |
| SCHEMBL19200474 | 0.81 | SLC6A4 (0.49) | SLC6A4CYP1A2CYP2D6CYP2C19LDHA | |
| SCHEMBL10495976 | 0.80 | MMP1 (0.41) | MMP1MMP3MMP2MMP9ADAM17 | |
| SCHEMBL9502392 | 0.80 | MMP1 (0.41) | MMP1MMP3MMP2MMP9ADAM17 | |
| SCHEMBL17038559 | 0.80 | SLC6A4 (0.43) | SLC6A4CYP1A2CYP2D6CYP2C19LDHA | |
| SCHEMBL7276240 | 0.80 | MMP1 (0.41) | MMP1MMP3MMP2MMP9ADAM17 | |
| SCHEMBL7276267 | 0.80 | MMP1 (0.41) | MMP1MMP3MMP2MMP9ADAM17 | |
| SCHEMBL17152209 | 0.78 | HTT (0.54) | SLC6A4LDHAAAK1ALDH1A1 | |
| SCHEMBL9502464 | 0.78 | MMP9 (0.41) | MMP1MMP3MMP2MMP9ADAM17 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0612324-A1 | PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1994-08-31 | — | — | EP | disclosed |
| WO-1993009136-A1 | PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1993-05-13 | — | — | WO | disclosed |