Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 2/20 | 0.53 |
| ▸ | MMP9 | P14780 | 2/20 | 0.53 |
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | MMP1 | P03956 | 1/20 | 0.53 |
| ▸ | MMP3 | P08254 | 1/20 | 0.53 |
| ▸ | MMP8 | P22894 | 1/20 | 0.53 |
| ▸ | MMP13 | P45452 | 1/20 | 0.53 |
| ▸ | TAS1R3 | Q7RTX0 | 4/20 | 0.49 |
| ▸ | TAS1R1 | Q7RTX1 | 4/20 | 0.49 |
| ▸ | TAS1R2 | Q8TE23 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10700154 | 0.89 | ALDH1A1 (0.55) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL17017323 | 0.86 | HCRTR1 (0.55) | TAS1R3TAS1R1TAS1R2ALDH1A1NPC1 | |
| SCHEMBL4116189 | 0.85 | HDAC4 (0.52) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL4760506 | 0.85 | HDAC4 (0.52) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL4711538 | 0.85 | HDAC4 (0.52) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL9701078 | 0.85 | HDAC4 (0.52) | MMP2MMP9CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL17007131 | 0.85 | HCRTR1 (0.54) | TAS1R3TAS1R1TAS1R2ALDH1A1NPC1 | |
| Hydrochloric Acid SCHEMBL17028057 | 0.85 | HCRTR1 (0.54) | TAS1R3TAS1R1TAS1R2ALDH1A1NPC1 | |
| SCHEMBL28037674 | 0.81 | MMP2 (0.52) | MMP2MMP9CA12CA1CA2 | |
| SCHEMBL31267432 | 0.79 | ALDH1A1 (0.59) | TAS1R3TAS1R1TAS1R2ALDH1A1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993002707-A1 | NEW ANTI-DIARRHEIC AGENTS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1993-02-18 | — | — | WO | claimed |