Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | EDNRB | P24530 | 1/20 | 0.32 |
| ▸ | EDNRA | P25101 | 1/20 | 0.32 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 3/20 | 0.32 |
| ▸ | F10 | P00742 | 2/20 | 0.32 |
| ▸ | BMP1 | P13497 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 2/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL4046098 | 0.93 | CTSK (0.39) | PKMTSHRALDH1A1HPGDLMNA | |
| SCHEMBL4049558 | 0.90 | CTSK (0.36) | F2F10ELANECTSK | |
| SCHEMBL4048294 | 0.89 | ALDH1A1 (0.37) | TSHRALDH1A1HPGDLMNACHRM5 | |
| SCHEMBL4041133 | 0.88 | CTSK (0.36) | ALDH1A1F2F10ELANECTSK | |
| SCHEMBL4044073 | 0.86 | CTSK (0.33) | F2F10CTSK | |
| SCHEMBL4051941 | 0.85 | ELOVL6 (0.38) | TSHRLMNACTSK | |
| SCHEMBL4048186 | 0.85 | ALDH1A1 (0.36) | ALDH1A1LMNACHRM5KDM4ECTSK | |
| SCHEMBL4045941 | 0.85 | CTSK (0.33) | F2F10CTSK | |
| SCHEMBL4046418 | 0.84 | CTSK (0.33) | F2F10CTSK | |
| SCHEMBL4044424 | 0.84 | CTSK (0.34) | F2F10CTSK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | claimed |