Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 2/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2751647 | 0.81 | KMO (0.33) | TSHRKMOMAOB | |
| SCHEMBL9956286 | 0.79 | ENPP3 (0.45) | IDO1NOTUMNPC1TP53TSHR | |
| SCHEMBL9955620 | 0.79 | IDO1 (0.45) | IDO1NOTUMNPC1TP53NFKB1 | |
| SCHEMBL2096790 | 0.77 | NOTUM (0.38) | NOTUMNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL102449 | 0.77 | RAB9A (0.41) | IDO1NOTUMNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2096696 | 0.76 | AHR (0.46) | NOTUMNPC1RAB9AKMO | |
| SCHEMBL17028965 | 0.75 | IDO1 (0.49) | IDO1NOTUMRAB9AKMOMAOB | |
| SCHEMBL2092189 | 0.75 | DYRK1A (0.47) | NOTUMNPC1TP53NFKB1RAB9A | |
| SCHEMBL2751044 | 0.73 | ALDH1A1 (0.41) | NOTUMNPC1RAB9AKMOMAOB | |
| SCHEMBL8123490 | 0.72 | IDO1 (0.35) | IDO1NPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015124606-A1 | N-SUBSTITUTED IMINO HETEROCYCLIC COMPOUNDS FOR COMBATING INVERTEBRATE PESTS | BASF SE (DE) | 2015-08-27 | — | — | WO | disclosed |
| WO-2012085852-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-8-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |
| WO-2012085857-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-3-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |