Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.67 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | AGXT | P21549 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TACR1 | P25103 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16478 | 0.97 | TSHR (0.70) | TSHRIDO1TP53AGXTALDH1A1 | |
| SCHEMBL27473996 | 0.95 | TSHR (0.67) | TSHRIDO1TP53AGXTALDH1A1 | |
| SCHEMBL27536462 | 0.95 | TSHR (0.67) | TSHRIDO1TP53AGXTALDH1A1 | |
| Water SCHEMBL27893853 | 0.95 | TSHR (0.67) | TSHRIDO1TP53AGXTALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL2308512 | 0.95 | TSHR (0.67) | TSHRIDO1TP53AGXTALDH1A1 | |
| SCHEMBL25430960 | 0.95 | TSHR (0.67) | TSHRIDO1TP53AGXTALDH1A1 | |
| SCHEMBL27338877 | 0.95 | TSHR (0.67) | TSHRIDO1TP53AGXTALDH1A1 | |
| Water SCHEMBL27795742 | 0.95 | TSHR (0.67) | TSHRIDO1TP53AGXTALDH1A1 | |
| Bromide SCHEMBL20577438 | 0.95 | TSHR (0.67) | TSHRIDO1TP53AGXTALDH1A1 | |
| Ethylene SCHEMBL27782087 | 0.93 | TSHR (0.64) | TSHRIDO1TP53AGXTALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101056843-B | Process for producing macrocyclic ketones and intermediates therefor | TAKASAGO PERFUMERY CO LTD | 2011-02-16 | — | — | CN | disclosed |
| CN-101056843-A | Process for producing macrocyclic ketones and intermediates therefor | TAKASAGO PERFUMERY CO LTD (JP) | 2007-10-17 | — | — | CN | disclosed |