Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | BAZ2B | Q9UIF8 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 5/20 | 0.37 |
| ▸ | RET | P07949 | 5/20 | 0.37 |
| ▸ | KDR | P35968 | 5/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 4/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 4/20 | 0.37 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | EP300 | Q09472 | 1/20 | 0.36 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2257179 | 0.90 | NOTUM (0.46) | NOTUMHRH3BAZ2BMAPTLMNA | |
| SCHEMBL8325734 | 0.85 | NOTUM (0.42) | NOTUMHRH3BAZ2BMAPTLMNA | |
| SCHEMBL8325730 | 0.85 | NOTUM (0.42) | NOTUMHRH3BAZ2BMAPTLMNA | |
| SCHEMBL8325983 | 0.84 | ESR1 (0.48) | CES1EP300CREBBPLIG1 | |
| SCHEMBL8326465 | 0.81 | CES1 (0.40) | GSK3BCES1 | |
| SCHEMBL8329492 | 0.73 | BAZ2B (0.43) | BAZ2BMAPTLCKRETKDR | |
| SCHEMBL2255155 | 0.73 | NOTUM (0.50) | NOTUMMAPTALDH1A1CES1LIG1 | |
| SCHEMBL8327753 | 0.73 | CES1 (0.42) | ALDH1A1CES1LIG1 | |
| SCHEMBL2254584 | 0.70 | PARP1 (0.53) | CES1LIG1 | |
| SCHEMBL2251074 | 0.70 | PARP1 (0.57) | CES1LIG1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0529636-B1 | Novel isatinoxime derivatives, their preparation and use | NEUROSEARCH AS (DK) | 1999-06-23 | — | — | EP | disclosed |
| US-5436250-A | Isatineoxime derivatives, their preparation and use | NEUROSEARCH A/S (DK) | 1995-07-25 | — | — | US | disclosed |
| US-5242918-A | Isatinoxime derivatives, their preparation and use | NEUROSEARCH A/S (DK) | 1993-09-07 | — | — | US | disclosed |
| WO-1993005043-A1 | NOVEL ISATINOXIME DERIVATIVES, THEIR PREPARATION AND USE | NEUROSEARCH A/S (DK) | 1993-03-18 | — | — | WO | disclosed |
| EP-0529636-A1 | Novel isatinoxime derivatives, their preparation and use | NEUROSEARCH A/S (DK) | 1993-03-03 | — | — | EP | disclosed |