Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | FDPS | P14324 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CTSA | P10619 | 12/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22744636 | 0.78 | NOS1 (0.39) | NOS1FDPSSMN1; SMN2CTSASLC6A3 | |
| SCHEMBL12179253 | 0.75 | — | — | |
| SCHEMBL3698239 | 0.71 | NOS1 (0.39) | NOS1FDPSCTSASLC6A3 | |
| SCHEMBL765512 | 0.70 | — | — | |
| SCHEMBL22744107 | 0.69 | HCAR2 (0.37) | — | |
| SCHEMBL16116375 | 0.69 | CTSA (0.41) | NOS1FDPSCTSA | |
| SCHEMBL19504364 | 0.69 | — | — | |
| SCHEMBL14166842 | 0.68 | NOS1 (0.41) | NOS1FDPSSMN1; SMN2CTSANPC1 | |
| SCHEMBL24963250 | 0.67 | — | — | |
| SCHEMBL20989488 | 0.67 | — | — |
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-2020239999-A1 | SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE | JANSSEN PHARMACEUTICA NV (BE) | 2020-12-03 | — | — | WO | disclosed |