Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 6/20 | 0.38 |
| ▸ | EGFR | P00533 | 5/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 5/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.36 |
| ▸ | TUBB | P07437 | 2/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5440544 | 0.73 | RAB9A (0.52) | MEN1NPC1RAB9AKMT2ACSF1R | |
| SCHEMBL5331387 | 0.72 | EGFR (0.43) | DHFRKDREGFRPDGFRBPDGFRA | |
| SCHEMBL5579182 | 0.70 | RAB9A (0.55) | KDREGFRPDGFRBPDGFRAMEN1 | |
| Hydrochloric Acid SCHEMBL5579229 | 0.69 | RAB9A (0.57) | KDREGFRPDGFRBPDGFRAMEN1 | |
| SCHEMBL114319 | 0.64 | CA1 (0.61) | DHFRKDREGFRPDGFRBNPC1 | |
| SCHEMBL5376106 | 0.64 | ALDH1A1 (0.32) | MEN1NPC1RAB9AKMT2ACASP3 | |
| SCHEMBL5311385 | 0.63 | ALDH1A1 (0.35) | MEN1KMT2AGAA | |
| Hydrochloric Acid SCHEMBL29089898 | 0.62 | CA1 (0.58) | KDREGFRPDGFRBNPC1RAB9A | |
| SCHEMBL257718 | 0.61 | ACHE (0.68) | KDREGFRPDGFRBPDGFRANPC1 | |
| SCHEMBL13367409 | 0.61 | TSPO (0.51) | DHFRKDREGFRPDGFRBPDGFRA |
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-2007056214-A2 | N-ALKYL-N-ARYL-THIENOPYRIMIDIN-R-AMINES AND USES THEREOF | CYTOVIA, INC (US) | 2007-05-18 | — | — | WO | disclosed |