Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL257683 | 1.00 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2MAPK1CA1CA2 | |
| SCHEMBL19055312 | 1.00 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2MAPK1CA1CA2 | |
| SCHEMBL19055335 | 1.00 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2MAPK1CA1CA2 | |
| SCHEMBL12165146 | 0.98 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2MAPK1CA1CA2 | |
| SCHEMBL12165148 | 0.98 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2MAPK1CA1CA2 | |
| SCHEMBL12165151 | 0.95 | — | — | |
| SCHEMBL21020980 | 0.95 | — | — | |
| SCHEMBL1911327 | 0.95 | — | — | |
| SCHEMBL21357944 | 0.84 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2MAPK1KDM4E | |
| SCHEMBL15424813 | 0.81 | CYP19A1 (0.33) | CA1CA2CA4CYP19A1KDM4E |
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-2015002918-A1 | IDO INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2015-01-08 | — | — | WO | disclosed |