Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.35 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.35 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.35 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.35 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.35 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.35 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.35 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.35 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.35 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.35 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.35 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.35 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22604964 | 0.86 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2TUBB4ATUBBTUBA3C | |
| SCHEMBL22452406 | 0.83 | TUBB4A (0.38) | ALDH1A1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL28057702 | 0.79 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2KDM4EPTGS2RAB9A | |
| SCHEMBL22452273 | 0.79 | TUBB4A (0.55) | ALDH1A1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL18970011 | 0.79 | KDM4E (0.52) | ALDH1A1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL22452266 | 0.77 | — | — | |
| SCHEMBL12509360 | 0.77 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2KDM4EPTGS2RAB9A | |
| SCHEMBL20522779 | 0.75 | SLC6A3 (0.42) | ALDH1A1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL22604902 | 0.75 | TUBB4A (0.41) | ALDH1A1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL20263273 | 0.75 | CA3 (0.38) | ALDH1A1SMN1; SMN2RAB9ATDP1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105712974-A | Certain Amino-Pyridazines, Compositions Thereof, And Methods Of Their Use | 赛特凯恩蒂克公司 | 2016-06-29 | — | — | CN | disclosed |
| CN-103025331-B | Certain amino-pyrimidines, compositions thereof and methods of use thereof | CYTOKINETICS, INC. (US) | 2016-03-02 | — | — | CN | disclosed |