Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL160053 | 0.81 | ADORA2B (0.36) | ATRMAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL7228617 | 0.81 | ALDH1A1 (0.43) | MAPTSMN1; SMN2RAB9AHSD17B10HPGD | |
| SCHEMBL2872850 | 0.77 | TSHR (0.50) | MAPTSMN1; SMN2NPC1RAB9ATP53 | |
| SCHEMBL27718695 | 0.75 | TDP1 (0.36) | MAPTSMN1; SMN2NPC1RAB9ATP53 | |
| SCHEMBL9179871 | 0.74 | ALDH1A1 (0.53) | MAPTSMN1; SMN2NPC1RAB9AHTT | |
| SCHEMBL27739732 | 0.73 | CA12 (0.36) | MAPTSMN1; SMN2NPC1RAB9ATP53 | |
| SCHEMBL29952357 | 0.73 | RAB9A (0.42) | ATRMAPTSMN1; SMN2NPC1RAB9A | |
| Ethylene SCHEMBL28215210 | 0.72 | CHRM2 (0.36) | SMN1; SMN2NPC1RAB9AHTTKMT2A | |
| SCHEMBL9186294 | 0.71 | PKM (0.42) | SMN1; SMN2NPC1RAB9AHTTHSD17B10 | |
| SCHEMBL7475016 | 0.70 | HSP90AB1 (0.38) | MAPTSMN1; SMN2NPC1RAB9ATP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0530579-B1 | Condensed pyrimidine derivatives antitumor agents | EISAI CO LTD (JP) | 1998-11-11 | — | — | EP | disclosed |
| US-5688800-A | ANTITUMOR AGENTS | EISAI CO., LTD. (JP) | 1997-11-18 | — | — | US | disclosed |
| US-5554615-A | ANTITUMOR | EISAI CO., LTD. (JP) | 1996-09-10 | — | — | US | disclosed |
| EP-0530579-A1 | Condensed pyrimidine derivatives antitumor agents | Eisai Co., Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |