Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.50 |
| ▸ | ACACB | O00763 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7417003 | 0.81 | HTT (0.55) | MEN1KMT2ASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL27661058 | 0.81 | NQO1 (0.48) | NQO1ACACBTDP1SMN1; SMN2NPC1 | |
| SCHEMBL2628188 | 0.79 | POLB (0.59) | NQO1MEN1LMNACYP1A2KMT2A | |
| SCHEMBL6650453 | 0.79 | NQO1 (0.61) | NQO1MEN1LMNACYP1A2KMT2A | |
| SCHEMBL503308 | 0.76 | PLA2G4B (0.58) | NQO1TDP1SMN1; SMN2NPC1HPGD | |
| SCHEMBL700166 | 0.74 | PARP10 (0.61) | NQO1LMNACYP1A2TDP1ALDH1A1 | |
| SCHEMBL10884546 | 0.74 | NQO1 (0.54) | NQO1MEN1LMNACYP1A2KMT2A | |
| SCHEMBL2126901 | 0.74 | NQO1 (0.54) | NQO1MEN1LMNACYP1A2KMT2A | |
| SCHEMBL2528806 | 0.74 | ALDH1A1 (0.54) | NQO1MEN1LMNACYP1A2KMT2A | |
| SCHEMBL6709316 | 0.74 | NQO1 (0.54) | NQO1MEN1LMNACYP1A2KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6482824-B1 | Use of n-substituted (3,6-dihydro)-2h-1,2-oxazine derivatives as selective mglur1 antagonists | ELI LILLY AND COMPANY | 2002-11-19 | — | — | US | disclosed |
| EP-1124806-A2 | USE OF N-SUBSTITUTED (3,6-DIHYDRO)-2H-1,2-OXAZINE DERIVATIVES AS SELECTIVE MGLUR1 ANTAGONISTS | ELI LILLY AND COMPANY LIMITED (GB) | 2001-08-22 | — | — | EP | disclosed |
| WO-2000026199-A2 | USE OF N-SUBSTITUTED (3,6-DIHYDRO)-2H-1,2-OXAZINE DERIVATIVES AS SELECTIVE MGLUR1 ANTAGONISTS | ELI LILLY AND COMPANY LIMITED (GB) | 2000-05-11 | — | — | WO | disclosed |
| WO-2000026198-A1 | N-SUBSTITUTED (3,6-DIHYDRO)-2H-1,2-OXAZINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS SELECTIVE MGLUR1 ANTAGONISTS | ELI LILLY AND COMPANY LIMITED (GB) | 2000-05-11 | — | — | WO | disclosed |