Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.69 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.69 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.69 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
| ▸ | NAMPT | P43490 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL19634439 | 0.91 | NPSR1 (0.67) | HDAC6HDAC2HDAC8MEN1KMT2A | |
| SCHEMBL19634451 | 0.90 | NPSR1 (0.65) | HDAC6HDAC2HDAC8MEN1KMT2A | |
| SCHEMBL19634412 | 0.88 | HDAC6 (0.53) | HDAC6HDAC2HDAC8MEN1KMT2A | |
| SCHEMBL23471332 | 0.87 | HDAC6 (0.52) | HDAC6HDAC2HDAC8KMT2AHDAC1 | |
| SCHEMBL19634426 | 0.87 | CD274 (0.67) | POLBALDH1A1NAMPT | |
| SCHEMBL23471160 | 0.87 | HASPIN (0.55) | HDAC6HDAC2HDAC8HDAC1NPSR1 | |
| SCHEMBL21015348 | 0.86 | HDAC6 (0.64) | HDAC6HDAC2HDAC8MEN1KMT2A | |
| SCHEMBL19634745 | 0.85 | PARP1 (0.59) | HDAC6HDAC2HDAC8POLBCYP2C9 | |
| SCHEMBL11983548 | 0.82 | HDAC2 (0.78) | HDAC6HDAC2HDAC8MEN1KMT2A | |
| SCHEMBL23471208 | 0.82 | KMT2A (0.61) | HDAC6MEN1KMT2AHDAC1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-3831841-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T Global Inc. (US) | 2021-06-09 | — | — | EP | disclosed |
| WO-2017200984-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T GLOBAL INC. (US) | 2017-11-23 | — | — | WO | disclosed |