Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 10/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 2/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8523005 | 0.76 | KIF11 (0.45) | KIF11KCNH2TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL12210538 | 0.73 | CA4 (0.48) | KIF11KCNH2LTA4HTRPA1CA4 | |
| SCHEMBL8457643 | 0.73 | CA4 (0.48) | KIF11KCNH2TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL11005672 | 0.72 | PKM (0.48) | KIF11KCNH2TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL6696092 | 0.71 | KIF11 (0.43) | KIF11KCNH2TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL10695316 | 0.71 | KIF11 (0.44) | KIF11KCNH2TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL3024596 | 0.71 | KIF11 (0.44) | KIF11KCNH2TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL3932304 | 0.71 | CA4 (0.50) | KIF11KCNH2LTA4HTRPA1CA4 | |
| SCHEMBL10613656 | 0.71 | TAAR1 (0.42) | TSHRSMN1; SMN2ALDH1A1CYP3A4ALOX15 | |
| SCHEMBL4017205 | 0.71 | CA4 (0.50) | KIF11KCNH2LTA4HTRPA1CA4 |
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-4533497-A | N-ethylidene azetidinones | ELI LILLY AND COMPANY (US) | 1985-08-06 | — | — | US | disclosed |