Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18670053 | 0.92 | KDM4E (0.46) | CA1CA2CA12CA7CA9 | |
| SCHEMBL8618607 | 0.81 | KDM4E (0.44) | CA1CA2CA12CA7CA9 | |
| SCHEMBL6848062 | 0.79 | KDM4E (0.46) | CA1CA2CA12CA7CA9 | |
| SCHEMBL4611677 | 0.78 | ALDH1A1 (0.49) | CA1CA2CA12CA7CA9 | |
| SCHEMBL9660736 | 0.78 | POLB (0.48) | CA1CA2CA12CA7CA9 | |
| SCHEMBL9219368 | 0.74 | TSHR (0.67) | TSHRKDM4EL3MBTL1MAPTSMN1; SMN2 | |
| SCHEMBL16666658 | 0.74 | ALDH1A1 (0.53) | KDM4EALDH1A1HSD17B10 | |
| SCHEMBL4691963 | 0.73 | CA12 (0.50) | CA1CA2CA12CA7CA9 | |
| SCHEMBL28468180 | 0.72 | ALDH1A1 (0.44) | KDM4ELMNAALDH1A1HSD17B10MAPK1 | |
| SCHEMBL18544164 | 0.72 | CES2 (0.42) | KDM4EL3MBTL1SMN1; SMN2ALDH1A1HSD17B10 |
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-2017050685-A1 | PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH 5-MEMBERED SULFUR CONTAINING HETEROCYCLIC RING SYSTEMS | SYNGENTA PARTICIPATIONS AG (CH) | 2017-03-30 | — | — | WO | disclosed |