Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB3 | Q13509 | 9/20 | 0.43 |
| ▸ | KDR | P35968 | 8/20 | 0.43 |
| ▸ | EGFR | P00533 | 4/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 4/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 5/20 | 0.40 |
| ▸ | TUBB | P07437 | 5/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 5/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 5/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 5/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 5/20 | 0.40 |
| ▸ | TUBB2A | Q13885 | 5/20 | 0.40 |
| ▸ | TUBB8 | Q3ZCM7 | 5/20 | 0.40 |
| ▸ | TUBA3E | Q6PEY2 | 5/20 | 0.40 |
| ▸ | TUBA1A | Q71U36 | 5/20 | 0.40 |
| ▸ | TUBA1C | Q9BQE3 | 5/20 | 0.40 |
| ▸ | TUBB6 | Q9BUF5 | 5/20 | 0.40 |
| ▸ | TUBB2B | Q9BVA1 | 5/20 | 0.40 |
| ▸ | TUBB1 | Q9H4B7 | 5/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4300169 | 0.77 | KDR (0.51) | TUBB3KDREGFRPDGFRBABCB1 | |
| SCHEMBL13611581 | 0.70 | KDR (0.53) | TUBB3KDREGFRPDGFRBABCB1 | |
| SCHEMBL20111051 | 0.68 | KDR (0.47) | TUBB3KDREGFRPDGFRBABCB1 | |
| SCHEMBL4295522 | 0.66 | MAPT (0.43) | TUBB3KDREGFRPDGFRBABCB1 | |
| SCHEMBL4300255 | 0.66 | MEN1 (0.53) | TUBB3KDREGFRPDGFRBABCB1 | |
| SCHEMBL114319 | 0.63 | CA1 (0.61) | TUBB3KDREGFRPDGFRBTUBB4A | |
| SCHEMBL4303340 | 0.63 | POLB (0.44) | TUBB3KDREGFRPDGFRBABCB1 | |
| SCHEMBL14372143 | 0.63 | NQO2 (0.49) | TUBB3TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL4297485 | 0.62 | SMN1; SMN2 (0.52) | TUBB3KDREGFRPDGFRBABCB1 | |
| Hydrochloric Acid SCHEMBL29089898 | 0.62 | CA1 (0.58) | TUBB3KDREGFRPDGFRBABCB1 |
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-3130585-A2 | PYRROLO[3,2-D]PYRIMIDINE-4-AMINE DERIVATIVES AND RELATED COMPOUNDS FOR THE TREATMENT OF CANCER | Duquesne University of The Holy Spirit (US) | 2017-02-15 | — | — | EP | disclosed |