Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 8/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.45 |
| ▸ | MMP3 | P08254 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL25833121 | 0.96 | EPHX1 (0.50) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 | |
| SCHEMBL885086 | 0.91 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 | |
| SCHEMBL2047092 | 0.91 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 | |
| SCHEMBL13074022 | 0.91 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 | |
| SCHEMBL3038208 | 0.91 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 | |
| SCHEMBL13366811 | 0.91 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 | |
| SCHEMBL16317723 | 0.91 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 | |
| SCHEMBL16317726 | 0.91 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 | |
| SCHEMBL15632426 | 0.91 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 | |
| SCHEMBL396759 | 0.91 | EPHX1 (0.64) | EPHX1NPC1SMN1; SMN2RAB9AEPHX2 |
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-2023133260-A2 | CHEMICAL TARGETING SWI/SNF RELATED, MATRIX ASSOCIATED, ACTIN DEPENDENT REGULATOR OF CHROMATIN, SUBFAMILY A, MEMBER 4 (SMARCA4) AND USE IN DIFFUSE INTRINSIC PONTINE GLIOMA (DIPG) | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2023-07-13 | — | — | WO | disclosed |