Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.32 |
| ▸ | TDO2 | P48775 | 3/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | CFD | P00746 | 2/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.31 |
| ▸ | MT-CO1 | P00395 | 1/20 | 0.31 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9497838 | 1.00 | CA1 (0.39) | CA1CA2CA4TSHRSMN1; SMN2 | |
| Oxalic Acid SCHEMBL9795235 | 0.95 | CA1 (0.36) | CA1CA2CA4TSHRSMN1; SMN2 | |
| Oxalic Acid SCHEMBL9795230 | 0.95 | CA1 (0.36) | CA1CA2CA4TSHRSMN1; SMN2 | |
| SCHEMBL9498434 | 0.84 | CA1 (0.44) | CA1CA2CA4TSHRSMN1; SMN2 | |
| Oxalic Acid SCHEMBL9795133 | 0.80 | CA1 (0.41) | CA1CA2CA4TSHRSMN1; SMN2 | |
| Oxalic Acid SCHEMBL9795140 | 0.80 | CA1 (0.41) | CA1CA2CA4TSHRSMN1; SMN2 | |
| SCHEMBL9795241 | 0.78 | IDO1 (0.33) | SMN1; SMN2HSD17B10TDO2IDO1 | |
| SCHEMBL30421032 | 0.78 | CA1 (0.47) | CA1CA2CA4TSHRP2RX7 | |
| SCHEMBL19116649 | 0.77 | CA1 (0.39) | CA1CA2CA4TSHRSMN1; SMN2 | |
| SCHEMBL15541569 | 0.75 | EPHX1 (0.49) | CA1CA2CA4TSHR |
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-5037849-A | For treatment of heart and circulatory diseases | BOEHRINGER MANNHEIM GMBH (DE) | 1991-08-06 | — | — | US | disclosed |