Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.47 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.47 |
| ▸ | TRPC4 | Q9UBN4 | 1/20 | 0.47 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 4/20 | 0.40 |
| ▸ | PRKCG | P05129 | 4/20 | 0.40 |
| ▸ | PRKCB | P05771 | 4/20 | 0.40 |
| ▸ | PRKCA | P17252 | 4/20 | 0.40 |
| ▸ | PRKCH | P24723 | 4/20 | 0.40 |
| ▸ | PRKCI | P41743 | 4/20 | 0.40 |
| ▸ | PRKCE | Q02156 | 4/20 | 0.40 |
| ▸ | PRKCQ | Q04759 | 4/20 | 0.40 |
| ▸ | PRKCZ | Q05513 | 4/20 | 0.40 |
| ▸ | PRKCD | Q05655 | 4/20 | 0.40 |
| ▸ | PRKD1 | Q15139 | 4/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6034415 | 0.79 | BCHE (0.72) | BCHETRPC3TRPC4TRPC5TSHR | |
| SCHEMBL7217251 | 0.79 | ALDH1A1 (0.48) | TSHRKDM4EALDH1A1APPHSD17B10 | |
| SCHEMBL18934416 | 0.77 | KDM4E (0.70) | BCHETRPC3TRPC4TRPC5KDM4E | |
| SCHEMBL6856197 | 0.77 | ALDH1A1 (0.44) | TSHRKDM4EALDH1A1APPHSD17B10 | |
| SCHEMBL30013315 | 0.77 | ALDH1A1 (0.44) | TSHRKDM4EALDH1A1APPHSD17B10 | |
| SCHEMBL178850 | 0.76 | MARS1 (0.46) | — | |
| SCHEMBL178859 | 0.76 | MARS1 (0.51) | KCNH2 | |
| SCHEMBL4640893 | 0.75 | BCHE (0.70) | BCHETRPC3TRPC4TRPC5TSHR | |
| SCHEMBL6439777 | 0.74 | BCHE (0.68) | BCHETRPC3TRPC4TRPC5TSHR | |
| SCHEMBL5668076 | 0.72 | MARS1 (0.59) | — |
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-2000071524-A1 | 2-NH-PYRIDONES AND PYRIMIDONES AS MRS INHIBITORS | SMITHKLINE BEECHAM PLC (GB) | 2000-11-30 | — | — | WO | disclosed |