Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL11139218 | 0.85 | GAA (0.47) | CA2ALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL11581645 | 0.81 | CA2 (0.42) | CA2ALDH1A1GABRA1GABRB2TSHR | |
| SCHEMBL11011851 | 0.80 | ALDH1A1 (0.53) | CA2ALDH1A1KDM4EHPGDGABRA1 | |
| SCHEMBL11685439 | 0.78 | ALDH1A1 (0.42) | ALDH1A1KDM4EHPGDTSHRTDP1 | |
| SCHEMBL11683328 | 0.77 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDTSHRTDP1 | |
| SCHEMBL9514064 | 0.76 | CA2 (0.55) | CA2ALDH1A1GABRA1GABRB2TSHR | |
| SCHEMBL1187217 | 0.76 | MEN1 (0.57) | CA2ALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL29000698 | 0.75 | CYP2C19 (0.52) | CA2ALDH1A1KDM4EHPGDGABRA1 | |
| SCHEMBL9007187 | 0.75 | BCL2 (0.44) | ALDH1A1KDM4EHPGDTSHRTDP1 | |
| SCHEMBL11682660 | 0.74 | BCL2 (0.43) | BCL2BCL2L1 |
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-4029818-A | Process for inhibiting the deterioration of wood due to marine boring organisms via the use of dibutylbenzylphenol | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1977-06-14 | — | — | US | disclosed |