Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | ITGA1 | P56199 | 2/20 | 0.36 |
| ▸ | EDNRA | P25101 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30806178 | 1.00 | AKR1B1 (0.40) | AKR1B1MCL1TSHRHPGDTRPV4 | |
| SCHEMBL10871074 | 0.87 | TRPV4 (0.37) | MCL1TSHRHPGDTRPV4LMNA | |
| SCHEMBL5655549 | 0.85 | MCL1 (0.46) | AKR1B1MCL1TSHRHPGDLMNA | |
| SCHEMBL5652756 | 0.84 | F2 (0.36) | TRPV4LMNAHSD11B1 | |
| SCHEMBL7472557 | 0.82 | CCR2 (0.44) | TRPV4LMNAALDH1A1 | |
| SCHEMBL8853900 | 0.81 | MAPK1 (0.58) | TSHRTRPV4 | |
| SCHEMBL5700086 | 0.77 | HSD11B1 (0.42) | AKR1B1MCL1TSHRHPGDTRPV4 | |
| SCHEMBL1124590 | 0.77 | HSD11B1 (0.40) | AKR1B1TSHRHSD11B1ALDH1A1HTT | |
| SCHEMBL10864830 | 0.76 | MAPT (0.56) | HPGDLMNAMAPTALDH1A1 | |
| SCHEMBL38652730 | 0.75 | ALDH1A1 (0.51) | TSHRHPGDTRPV4MEN1LMNA |
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-4996208-A | Pesticidal thiazolopyrimidine derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1991-02-26 | — | — | US | disclosed |