Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CA3 | P07451 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8063025 | 0.75 | PDK2 (0.33) | TSHRTP53KDM4EALDH1A1MAPT | |
| SCHEMBL9683216 | 0.75 | TSHR (0.35) | CA2TSHRTP53CA1LMNA | |
| SCHEMBL3824691 | 0.71 | TXNRD1 (0.38) | TSHRTP53LMNAKDM4EALDH1A1 | |
| SCHEMBL2048287 | 0.68 | TSHR (0.46) | CA2TSHRTP53CA1LMNA | |
| Catechol SCHEMBL148586 | 0.62 | CA2 (0.71) | CA2TSHRTP53CA1LMNA | |
| SCHEMBL2201788 | 0.61 | — | — | |
| SCHEMBL28382869 | 0.60 | ALDH1A1 (0.43) | CA2TSHRTP53CA1LMNA | |
| SCHEMBL725435 | 0.60 | ALDH1A1 (0.43) | CA2TSHRTP53CA1LMNA | |
| Catechol SCHEMBL28214783 | 0.60 | CA2 (0.67) | CA2TSHRTP53CA1LMNA | |
| SCHEMBL28781240 | 0.59 | SIGMAR1 (0.38) | CA2TSHRTP53CA1ALDH1A1 |
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-2001091796-A2 | METHODS, COMPOUNDS AND COMPOSITIONS FOR TREATING GOUT | GUILFORD PHARMACEUTICALS INC. (US) | 2001-12-06 | — | — | WO | disclosed |