Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 11/20 | 0.39 |
| ▸ | MAOA | P21397 | 11/20 | 0.39 |
| ▸ | MAOB | P27338 | 11/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5321239 | 0.79 | NFKB1 (0.37) | NFKB1NFKB2RELATSHRCYP19A1 | |
| SCHEMBL10684852 | 0.76 | NFKB1 (0.35) | NFKB1NFKB2RELATSHRCYP19A1 | |
| SCHEMBL8286504 | 0.73 | KDM1A (0.41) | TSHRKDM1AMAOAMAOBGAA | |
| SCHEMBL2763632 | 0.67 | CYP19A1 (0.36) | NFKB1NFKB2RELATSHRCYP19A1 | |
| SCHEMBL2765360 | 0.67 | CYP19A1 (0.36) | NFKB1NFKB2RELATSHRCYP19A1 | |
| SCHEMBL2764958 | 0.67 | CYP19A1 (0.36) | NFKB1NFKB2RELATSHRCYP19A1 | |
| SCHEMBL29931742 | 0.67 | ALDH1A1 (0.35) | NFKB1NFKB2RELATSHRMAPT | |
| SCHEMBL3313168 | 0.65 | OPRK1 (0.36) | NFKB1NFKB2RELATSHRCYP19A1 | |
| SCHEMBL2784000 | 0.65 | OPRK1 (0.36) | NFKB1NFKB2RELATSHRCYP19A1 | |
| SCHEMBL9644214 | 0.64 | NFKB1 (0.40) | NFKB1NFKB2RELACYP19A1KDM1A |
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 |
|---|---|---|---|---|---|---|---|
| US-4963691-A | Spirodilactam derivatives | SHELL OIL COMPANY (US) | 1990-10-16 | — | — | US | disclosed |