Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 4/20 | 0.34 |
| ▸ | MMP9 | P14780 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | MMP1 | P03956 | 3/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
| ▸ | MMP3 | P08254 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8581699 | 0.86 | MMP13 (0.36) | MMP13MMP9ALDH1A1MMP1MMP2 | |
| SCHEMBL8581428 | 0.86 | CYP2C19 (0.35) | MMP13MMP9ALDH1A1MMP1MMP2 | |
| SCHEMBL8581031 | 0.85 | CMA1 (0.39) | MMP13MMP9ALDH1A1MMP1MMP2 | |
| SCHEMBL8583887 | 0.84 | ALDH1A1 (0.34) | MMP13MMP9ALDH1A1MMP1MMP2 | |
| SCHEMBL8580422 | 0.83 | ALDH1A1 (0.34) | MMP13MMP9ALDH1A1MMP1MMP2 | |
| SCHEMBL8529321 | 0.81 | SLC9A1 (0.39) | — | |
| SCHEMBL8584152 | 0.81 | KDM4E (0.34) | MMP13MMP9ALDH1A1MMP1MMP2 | |
| SCHEMBL8583897 | 0.79 | KDM4E (0.36) | ALDH1A1TSHRKDM4EHSD17B10HPGD | |
| SCHEMBL8585519 | 0.79 | KDM4E (0.35) | ALDH1A1TSHRKDM4EHSD17B10HPGD | |
| SCHEMBL8580828 | 0.78 | PPARA (0.38) | MMP13MMP9ALDH1A1MMP1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5840761-A | Alkylbenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-11-24 | — | — | US | disclosed |