Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18966770 | 0.89 | MTNR1A (0.36) | ALDH1A1MTNR1AMTNR1BCYP1A2MAPT | |
| SCHEMBL18966455 | 0.87 | ALDH1A1 (0.39) | ALDH1A1MTNR1AMTNR1BCYP1A2MAPT | |
| SCHEMBL18966457 | 0.87 | ALDH1A1 (0.43) | ALDH1A1MTNR1AMTNR1BCYP1A2MAPT | |
| SCHEMBL23129910 | 0.83 | TSHR (0.40) | ALDH1A1MTNR1AMTNR1BCYP1A2TSHR | |
| SCHEMBL23837605 | 0.83 | TSHR (0.40) | ALDH1A1MTNR1AMTNR1BCYP1A2TSHR | |
| SCHEMBL23130183 | 0.82 | TSHR (0.40) | ALDH1A1TSHRTDP1L3MBTL1TP53 | |
| SCHEMBL23130114 | 0.81 | TSHR (0.37) | ALDH1A1MTNR1AMTNR1BMAPTTSHR | |
| SCHEMBL23837594 | 0.81 | MTNR1A (0.37) | ALDH1A1MTNR1AMTNR1BCYP1A2MAPT | |
| SCHEMBL23130105 | 0.78 | TSHR (0.36) | ALDH1A1TSHRTDP1L3MBTL1TP53 | |
| SCHEMBL23130008 | 0.78 | TSHR (0.39) | ALDH1A1CYP1A2TSHRTDP1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3154989-B1 | BETA-LACTAMASE INHIBITORS | VENATORX PHARMACEUTICALS INC (US) | 2021-03-24 | — | — | EP | disclosed |