Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | MGMT | P16455 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31056280 | 0.81 | MAPT (0.48) | MAPTLMNAHTTRAB9ANPC1 | |
| SCHEMBL8884172 | 0.81 | GRIN2D (0.41) | MAPTLMNAHTTGRIN2DGRIN3B | |
| SCHEMBL4522152 | 0.81 | GRIN2D (0.41) | MAPTLMNAHTTRAB9ANPC1 | |
| SCHEMBL31128165 | 0.81 | GRIN2D (0.41) | MAPTLMNAHTTRAB9ANPC1 | |
| SCHEMBL7385881 | 0.81 | MAPT (0.48) | MAPTLMNAHTTRAB9ANPC1 | |
| SCHEMBL803098 | 0.79 | ALDH1A1 (0.47) | MAPTLMNAHTTRAB9ANPC1 | |
| SCHEMBL28720365 | 0.79 | GRIN2D (0.40) | MAPTLMNAHTTGRIN2DGRIN3B | |
| SCHEMBL2322399 | 0.74 | GRIN2D (0.49) | MAPTLMNAHTTGRIN2DGRIN3B | |
| SCHEMBL9721947 | 0.72 | NOS3 (0.55) | MAPTLMNAHTTRAB9ANPC1 | |
| SCHEMBL26694656 | 0.72 | KDM4E (0.42) | MAPTLMNAHTTKMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109843874-A | Inhibitor as PARP1, PARP2 and/or tubulin can be used for the phthalazine derivatives for the treatment of cancer | 加利福尼亚大学董事会 | 2019-06-04 | — | — | CN | disclosed |