Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17831344 | 0.86 | MAPT (0.51) | RAB9AMAPTSMN1; SMN2BACE1HPGD | |
| SCHEMBL16245709 | 0.86 | RAB9A (0.51) | RAB9AMAPTSMN1; SMN2BACE1HPGD | |
| SCHEMBL16264848 | 0.85 | TDP1 (0.48) | SMN1; SMN2HPGDKMT2ATDP1 | |
| SCHEMBL17827730 | 0.83 | PIN1 (0.58) | RAB9AMAPTSMN1; SMN2BACE1HPGD | |
| SCHEMBL18869078 | 0.78 | MEN1 (0.40) | MAPTHPGDKMT2AMEN1EGFR | |
| SCHEMBL16264855 | 0.77 | SYK (0.43) | RAB9AMAPTSMN1; SMN2NPC1KMT2A | |
| SCHEMBL18869322 | 0.73 | P2RX3 (0.43) | MAPTSMN1; SMN2NPC1TDP1 | |
| SCHEMBL18869373 | 0.73 | SYK (0.56) | MAPTHPGDKMT2AMEN1EGFR | |
| SCHEMBL18869076 | 0.72 | KDM4E (0.39) | MAPTHPGDKMT2AMEN1EGFR | |
| SCHEMBL8487005 | 0.72 | RAB9A (0.77) | RAB9AMAPTSMN1; SMN2HPGDNPSR1 |
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-2994471-B1 | MACROCYCLES AS KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2017-05-17 | — | — | EP | disclosed |