Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.38 |
| ▸ | LPAR5 | Q9H1C0 | 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 | |
|---|---|---|---|---|
| SCHEMBL30450627 | 1.00 | CA12 (0.42) | CA12CA1CA2CA7CA13 | |
| SCHEMBL8651400 | 0.81 | CA12 (0.45) | CA12CA1CA2CA7CA13 | |
| SCHEMBL27893515 | 0.81 | ALB (0.52) | CES2CES1DHODHL3MBTL1TDP1 | |
| SCHEMBL7605662 | 0.78 | CES2 (0.47) | CES2CES1TDP1ALDH1A1ALOX15 | |
| SCHEMBL8031428 | 0.77 | ALDH1A1 (0.54) | CA12CA1CA2CA7DHODH | |
| SCHEMBL14920304 | 0.77 | PTGS1 (0.44) | CA12CA1CA2CA7CA13 | |
| SCHEMBL12756987 | 0.77 | TDP1 (0.49) | CES2CES1POLBTDP1ALDH1A1 | |
| SCHEMBL27245275 | 0.74 | SRD5A2 (0.57) | POLBDHODHSRD5A2AKR1C3 | |
| SCHEMBL922752 | 0.74 | POLB (0.57) | POLBDHODHSRD5A2AKR1C3 | |
| SCHEMBL16087637 | 0.74 | CES2 (0.42) | CA12CA1CA2CA7CES2 |
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-2014137301-A1 | HYDRAZONES AND THIAZOLIDINONES DERIVED FROM DIFLUNISAL | KUCUKGUZEL SUKRIYE GUNIZ (TR) | 2014-09-12 | — | — | WO | disclosed |