Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | AGXT | P21549 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 7/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5158636 | 0.80 | TAAR1 (0.59) | TAAR1IDO1AGXTMAOBSLC6A3 | |
| SCHEMBL29813717 | 0.80 | TAAR1 (0.59) | TAAR1IDO1AGXTMAOBSLC6A3 | |
| SCHEMBL9557085 | 0.75 | TAAR1 (0.63) | TAAR1IDO1AGXTMIFSLC6A3 | |
| SCHEMBL70652 | 0.74 | — | — | |
| SCHEMBL29766236 | 0.74 | — | — | |
| SCHEMBL15994507 | 0.73 | TAAR1 (0.54) | TAAR1IDO1AGXTMAOBMIF | |
| SCHEMBL5350380 | 0.73 | TAAR1 (0.54) | TAAR1IDO1AGXTMAOBMIF | |
| SCHEMBL9626110 | 0.72 | TP53 (0.48) | TAAR1IDO1AGXTALDH1A1SMN1; SMN2 | |
| SCHEMBL2124083 | 0.71 | TAAR1 (0.52) | TAAR1IDO1AGXTMAOBMIF | |
| SCHEMBL31020055 | 0.71 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023068881-A1 | ARYL OR HETEROARYL DERIVATIVE, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF KINASE-RELATED DISEASES | 주식회사 보로노이바이오 | 2023-04-27 | — | — | WO | disclosed |