Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.60 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.45 |
| ▸ | TUBB | P07437 | 1/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.45 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.45 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.45 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.45 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1294783 | 0.82 | PTGS1 (0.62) | CYP2A6PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL1294782 | 0.82 | PTGS1 (0.62) | CYP2A6PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL80050 | 0.75 | CYP2A6 (0.64) | CYP2A6PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL11708827 | 0.75 | CYP2A6 (0.64) | CYP2A6PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL8996553 | 0.75 | CYP2A6 (0.64) | CYP2A6PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL15930269 | 0.75 | CYP2A6 (0.64) | CYP2A6PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL40953 | 0.75 | CYP2A6 (1.00) | CYP2A6PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL30076672 | 0.75 | CYP2A6 (1.00) | CYP2A6PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL17742294 | 0.72 | CYP2A6 (0.60) | CYP2A6PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL3080071 | 0.72 | CYP2A6 (0.60) | CYP2A6PTGS1PTGS2MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5126448-A | Anxiolytic agents, learning enhancement | ASAHI KASEI KOGYO K.K. (JP) | 1992-06-30 | — | — | US | disclosed |
| US-4654431-A | Photopolymerizable thioacrylate monomers | EASTMAN KODAK COMPANY (US) | 1987-03-31 | — | — | US | disclosed |