Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.43 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CASP6 | P55212 | 2/20 | 0.42 |
| ▸ | G6PD | P11413 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | BRS3 | P32247 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.39 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3361331 | 0.83 | TSHR (0.57) | TSHRCA1CA2CA9CASP6 | |
| SCHEMBL7781040 | 0.81 | TSHR (0.51) | TSHRCA1CA2CA9CASP6 | |
| SCHEMBL4444648 | 0.79 | G6PD (0.59) | TSHRCASP6G6PDCASP7ABCB11 | |
| SCHEMBL30934865 | 0.79 | G6PD (0.59) | TSHRCASP6G6PDCASP7ABCB11 | |
| SCHEMBL6804935 | 0.78 | TSHR (0.47) | TSHRSAE1UBA2CA1CA2 | |
| SCHEMBL9018807 | 0.77 | TSHR (0.50) | TSHRSAE1UBA2CA1CA2 | |
| SCHEMBL29024632 | 0.77 | USP2 (0.54) | TSHRSAE1UBA2CA1CA2 | |
| SCHEMBL8517324 | 0.77 | ALDH1A1 (0.68) | TSHRCA1CA2CA9CASP6 | |
| SCHEMBL6164527 | 0.75 | PARP1 (0.47) | SAE1UBA2CA1CA2CA9 | |
| SCHEMBL8676463 | 0.72 | FOLH1 (0.49) | TSHRBRS3HTTLTB4R2MMP12 |
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-5710166-A | N-acyl beta amino acid derivatives useful as platelet aggregation inhibitors | THE MONSANTO COMPANY (US) | 1998-01-20 | — | — | US | disclosed |