Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9360138 | 0.82 | MAPT (0.71) | MAOBRAB9AKDM4EMAPTNPC1 | |
| SCHEMBL9359517 | 0.82 | MAPT (0.71) | MAOBRAB9AKDM4EMAPTNPC1 | |
| SCHEMBL8542902 | 0.82 | RAB9A (0.71) | MAOBRAB9AKDM4EMAPTNPC1 | |
| SCHEMBL9778252 | 0.82 | MAOB (0.48) | MAOBRAB9AKDM4EMAPTNPC1 | |
| SCHEMBL9778371 | 0.82 | MAOB (0.48) | MAOBRAB9AKDM4EMAPTNPC1 | |
| SCHEMBL9778222 | 0.79 | MAOB (0.48) | MAOBRAB9AKDM4EMAPTNPC1 | |
| SCHEMBL9778246 | 0.78 | ALDH1A1 (0.53) | MAOBRAB9AKDM4EMAPTNPC1 | |
| SCHEMBL9778329 | 0.77 | MAPT (0.55) | MAOBRAB9AKDM4EMAPTNPC1 | |
| SCHEMBL9778214 | 0.77 | CA1 (0.53) | MAOBRAB9AKDM4EMAPTNPC1 | |
| SCHEMBL9778193 | 0.77 | PKM (0.51) | MAOBRAB9AKDM4EMAPTNPC1 |
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-4992203-A | Element comprising pyrazoline compound aligned for net non-centrosymmetry | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-02-12 | — | — | US | disclosed |
| EP-0240106-A2 | Non-linear optical elements and compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-10-07 | — | — | EP | disclosed |