Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 2/20 | 0.47 |
| ▸ | MMP7 | P09237 | 2/20 | 0.47 |
| ▸ | MMP14 | P50281 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10700258 | 0.88 | LMNA (0.45) | MMP2MMP7MMP14CA2ALDH1A1 | |
| SCHEMBL314732 | 0.85 | TSHR (0.50) | MMP2MMP14CA2ALDH1A1LMNA | |
| SCHEMBL8818862 | 0.85 | CA2 (0.39) | MMP2MMP7MMP14CA2ALDH1A1 | |
| SCHEMBL2685459 | 0.85 | ALDH1A1 (0.60) | ALDH1A1LMNANPC1MAPTMEN1 | |
| SCHEMBL19851244 | 0.85 | CA2 (0.41) | MMP2CA2ALDH1A1LMNAHTT | |
| SCHEMBL1171141 | 0.84 | HSD11B1 (0.50) | MMP2MMP7MMP14ALDH1A1LMNA | |
| SCHEMBL10766564 | 0.82 | HTT (0.61) | MMP2CA2ALDH1A1HTTMEN1 | |
| SCHEMBL9780984 | 0.82 | PSIP1 (0.55) | MMP2MMP14CA2KDM4EMAPT | |
| SCHEMBL15711923 | 0.82 | CA2 (0.47) | CA2ALDH1A1LMNAKDM4EMAPT | |
| SCHEMBL4611003 | 0.81 | CA2 (0.35) | CA2ALDH1A1LMNAMAPTHTT |
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-4659856-A | 4,4'-bis-(β-hydroxyethylsulfonyl)-biphenyl and its esters | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-04-21 | — | — | US | disclosed |