Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.46 |
| ▸ | CA1 | P00915 | 5/20 | 0.46 |
| ▸ | CA2 | P00918 | 5/20 | 0.46 |
| ▸ | CA9 | Q16790 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2187545 | 0.78 | TSHR (0.41) | CA12CA1CA2CA9TSHR | |
| SCHEMBL10910583 | 0.78 | CA12 (0.39) | CA12CA1CA2CA9TSHR | |
| SCHEMBL2185729 | 0.74 | KMT2A (0.45) | TSHRHIF1ACYP19A1LMNAKMT2A | |
| SCHEMBL10273422 | 0.74 | KMT2A (0.41) | CA12CA1CA2CA9HIF1A | |
| SCHEMBL3263969 | 0.71 | APOBEC3G (0.40) | CA12CA1CA2CA9HIF1A | |
| SCHEMBL28574383 | 0.71 | CA12 (0.51) | CA12CA1CA2CA9LMNA | |
| SCHEMBL342328 | 0.70 | HIF1A (0.37) | CA12CA1CA2CA9TSHR | |
| SCHEMBL27809179 | 0.69 | MEN1 (0.51) | CA12CA1CA2CA9TSHR | |
| SCHEMBL10911319 | 0.68 | KMT2A (0.36) | CA12CA1CA2CA9TSHR | |
| SCHEMBL4667331 | 0.68 | LMNA (0.53) | LMNAGAASMN1; SMN2KMT2AMEN1 |
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-2023288242-A1 | PI3Kα INHIBITORS AND METHODS OF USE THEREOF | RELAY THERAPEUTICS, INC. (US) | 2023-01-19 | — | — | WO | disclosed |