Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | BRD4 | O60885 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9056705 | 0.90 | SMN1; SMN2 (0.34) | ALDH1A1SMN1; SMN2KDM4EHTTMAPT | |
| SCHEMBL9055355 | 0.87 | GRIA1 (0.31) | ALDH1A1SMN1; SMN2MAPTMAPK1NPSR1 | |
| SCHEMBL9056485 | 0.86 | TSHR (0.38) | ALDH1A1SMN1; SMN2KDM4EHTTMAPT | |
| SCHEMBL9472968 | 0.80 | POLB (0.40) | CA1CA2CA4CA7PDGFRB | |
| SCHEMBL9472971 | 0.80 | POLB (0.40) | CA1CA2CA4CA7PDGFRB | |
| SCHEMBL9055289 | 0.78 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2KDM4EHTTMAPT | |
| SCHEMBL9055001 | 0.77 | SMN1; SMN2 (0.38) | ALDH1A1SMN1; SMN2KDM4ETSHRLMNA | |
| Hydrochloric Acid SCHEMBL8326431 | 0.73 | GRIA1 (0.36) | ALDH1A1MAPK1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8326429 | 0.73 | GRIA1 (0.36) | ALDH1A1MAPK1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8327819 | 0.72 | GRIA1 (0.40) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0522494-B1 | Novel isatineoxime derivatives, their preparation and use | NEUROSEARCH AS (DK) | 1996-10-02 | — | — | EP | disclosed |
| US-5223527-A | Isatineoxime derivatives and their use | NEUROSEARCH A/S (DK) | 1993-06-29 | — | — | US | disclosed |
| EP-0522494-A1 | Novel isatineoxime derivatives, their preparation and use | NEUROSEARCH A/S (DK) | 1993-01-13 | — | — | EP | disclosed |