Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 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 | |
|---|---|---|---|---|
| SCHEMBL16130358 | 0.88 | ALDH1A1 (0.39) | TSHRTDP1ALDH1A1CYP3A4LMNA | |
| SCHEMBL16130378 | 0.86 | ALDH1A1 (0.42) | TSHRALDH1A1CYP3A4LMNAUSP2 | |
| SCHEMBL24049939 | 0.84 | TSHR (0.38) | TSHRCA2CA9TDP1PSMB5 | |
| SCHEMBL9301011 | 0.83 | TSHR (0.43) | TSHRCA2CA9TDP1PSMB5 | |
| SCHEMBL28496420 | 0.80 | — | — | |
| SCHEMBL905193 | 0.80 | — | — | |
| SCHEMBL1110727 | 0.80 | — | — | |
| SCHEMBL13785332 | 0.79 | CHRNB2 (0.41) | TSHRALOX15ALDH1A1CYP3A4LMNA | |
| SCHEMBL14456617 | 0.79 | TSHR (0.41) | TSHRCA2CA9TDP1PSMB5 | |
| SCHEMBL19309165 | 0.79 | DPP4 (0.43) | TSHRCA2CA9TDP1PSMB5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021093860-A1 | SUBSTITUTED BIS-TRICYCLIC COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF | 南京知和医药科技有限公司 | 2021-05-20 | — | — | WO | disclosed |
| US-8846638-B2 | Macrocyclic nucleoside phosphoramidate derivatives | ENANTA PHARMACEUTICALS, INC. (US) | 2014-09-30 | — | — | US | disclosed |
| US-8846638-B2 | Macrocyclic nucleoside phosphoramidate derivatives | ENANTA PHARMACEUTICALS, INC. (US) | 2014-09-30 | — | — | US | disclosed |