Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 11/20 | 0.60 |
| ▸ | MMP13 | P45452 | 10/20 | 0.60 |
| ▸ | MMP2 | P08253 | 1/20 | 0.60 |
| ▸ | MMP9 | P14780 | 1/20 | 0.60 |
| ▸ | MMP14 | P50281 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | ANPEP | P15144 | 1/20 | 0.44 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.44 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1139007 | 1.00 | MMP12 (0.60) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL28009952 | 0.91 | MMP12 (0.50) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL27590297 | 0.91 | MMP12 (0.50) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL18063402 | 0.84 | TSHR (0.56) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL27547145 | 0.84 | CYP2C19 (0.49) | MMP2TSHRCYP2C19ALDH1A1MEN1 | |
| SCHEMBL5613749 | 0.83 | MMP12 (0.67) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL11548305 | 0.82 | TSHR (0.62) | TSHRCYP2C19ALDH1A1MEN1KMT2A | |
| SCHEMBL3097653 | 0.82 | TSHR (0.61) | TSHRCYP2C19ALDH1A1MEN1KMT2A | |
| SCHEMBL2561037 | 0.81 | TSHR (0.56) | TSHRCYP2C19ALDH1A1MEN1KMT2A | |
| SCHEMBL5743507 | 0.81 | TSHR (0.56) | TSHRCYP2C19ALDH1A1KCNH2KCNJ1 |
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-4818748-A | HYPOTENSIVE AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1989-04-04 | — | — | US | disclosed |