Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.65 |
| ▸ | GAA | P10253 | 3/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.65 |
| ▸ | USP2 | O75604 | 1/20 | 0.65 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.65 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.65 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | PDK1 | Q15118 | 6/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | APP | P05067 | 1/20 | 0.49 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.49 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.49 |
| ▸ | F7 | P08709 | 1/20 | 0.47 |
| ▸ | F3 | P13726 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30203906 | 1.00 | KMT2A (0.65) | KMT2AGAAMEN1USP2KEAP1 | |
| SCHEMBL25306337 | 0.84 | KMT2A (0.49) | KMT2AGAAMEN1USP2KEAP1 | |
| SCHEMBL9002920 | 0.84 | KMT2A (0.51) | KMT2AGAAMEN1USP2KEAP1 | |
| SCHEMBL22426419 | 0.81 | ALDH1A1 (0.56) | KMT2AGAAMEN1RAB9APOLB | |
| SCHEMBL10350386 | 0.79 | MEN1 (0.79) | KMT2AGAAMEN1USP2KEAP1 | |
| 2,4-Dihydroxybenzophenone SCHEMBL1699129 | 0.79 | MEN1 (1.00) | KMT2AGAAMEN1USP2KEAP1 | |
| 2,4-Dihydroxybenzophenone SCHEMBL39681 | 0.79 | MEN1 (1.00) | KMT2AGAAMEN1USP2KEAP1 | |
| 2,4-Dihydroxybenzophenone SCHEMBL30201813 | 0.79 | MEN1 (1.00) | KMT2AGAAMEN1USP2KEAP1 | |
| 2,4-Dihydroxybenzophenone SCHEMBL29351647 | 0.79 | MEN1 (1.00) | KMT2AGAAMEN1USP2KEAP1 | |
| 2,4-Dihydroxybenzophenone SCHEMBL28179616 | 0.79 | MEN1 (1.00) | KMT2AGAAMEN1USP2KEAP1 |
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-2020231979-A9 | SMALL MOLECULE INHIBITORS OF VIRAL REPLICATION | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2021-06-17 | — | — | WO | disclosed |
| WO-2020231979-A1 | SMALL MOLECULE INHIBITORS OF VIRAL REPLICATION | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2020-11-19 | — | — | WO | disclosed |