Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | MMP2 | P08253 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | MMP1 | P03956 | 1/20 | 0.52 |
| ▸ | MMP9 | P14780 | 1/20 | 0.52 |
| ▸ | MMP8 | P22894 | 1/20 | 0.52 |
| ▸ | MMP13 | P45452 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10817097 | 0.94 | CA2 (0.63) | CA2KDM4EMMP2CA1MMP1 | |
| SCHEMBL728028 | 0.86 | CA2 (0.59) | CA2KDM4EMMP2CA1MMP1 | |
| SCHEMBL370189 | 0.79 | CA2 (0.56) | CA2KDM4EMMP2CA1MMP1 | |
| SCHEMBL10967386 | 0.78 | CA2 (0.59) | CA2KDM4EMMP2CA1MMP1 | |
| SCHEMBL1269819 | 0.78 | CA2 (0.54) | CA2KDM4EMMP2CA1MMP1 | |
| SCHEMBL6223776 | 0.78 | CA2 (0.65) | CA2KDM4EMMP2CA1MMP1 | |
| SCHEMBL5605338 | 0.78 | CA2 (0.54) | CA2KDM4EMMP2CA1MMP1 | |
| SCHEMBL3928655 | 0.76 | CA2 (0.52) | CA2KDM4EMMP2CA1MMP1 | |
| SCHEMBL9181455 | 0.76 | ALDH1A1 (0.62) | CA2MMP2CA1MMP1MMP9 | |
| SCHEMBL7855522 | 0.74 | KDM4E (0.67) | CA2KDM4EMMP2CA1MMP1 |
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-4288454-A | Antiviral 1-adamantyl-3-(phenylsulfonyl)thioureas | HOFFMAN-LA ROCHE INC. (US) | 1981-09-08 | — | — | US | disclosed |