Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CCR8 | P51685 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | MITF | O75030 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | NTSR1 | P30989 | 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 | |
|---|---|---|---|---|
| SCHEMBL28618546 | 1.00 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL21670190 | 1.00 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL28613899 | 0.89 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL28613897 | 0.89 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL21699976 | 0.79 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2LMNAKMT2ATP53 | |
| SCHEMBL21670196 | 0.79 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2LMNAKMT2ATP53 | |
| SCHEMBL29592764 | 0.79 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2LMNAKMT2ATP53 | |
| SCHEMBL21700019 | 0.79 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2LMNAKMT2ATP53 | |
| SCHEMBL21700069 | 0.78 | ALDH1A1 (0.31) | ALDH1A1SMN1; SMN2KMT2AMEN1RAB9A | |
| SCHEMBL21670243 | 0.78 | ENPP2 (0.37) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020030781-A1 | TRICYCLIC INHIBITORS OF HEPATITIS B VIRUS | OSPEDALE SAN RAFFAELE S.R.L. (IT) | 2020-02-13 | — | — | WO | disclosed |
| EP-3608326-A1 | TRICYCLIC INHIBITORS OF HEPATITIS B VIRUS | IRBM S.P.A. (IT) | 2020-02-12 | — | — | EP | disclosed |