Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.54 |
| ▸ | NPC1 | O15118 | 7/20 | 0.54 |
| ▸ | GRM5 | P41594 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | CASP3 | P42574 | 2/20 | 0.49 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.49 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.49 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL514236 | 0.83 | RAB9A (0.57) | RAB9ANPC1GRM5SMN1; SMN2TSHR | |
| SCHEMBL23986463 | 0.83 | RAB9A (0.57) | RAB9ANPC1GRM5SMN1; SMN2TSHR | |
| SCHEMBL1545210 | 0.82 | RAB9A (0.56) | RAB9ANPC1GRM5SMN1; SMN2TSHR | |
| SCHEMBL4106551 | 0.82 | NOTUM (0.66) | RAB9ANPC1GRM5SMN1; SMN2TSHR | |
| SCHEMBL12449564 | 0.82 | ALDH1A1 (0.43) | RAB9ANPC1SMN1; SMN2TSHRKDM4E | |
| SCHEMBL13046 | 0.79 | RAB9A (0.56) | RAB9ANPC1GRM5SMN1; SMN2TSHR | |
| SCHEMBL12494 | 0.76 | RAB9A (0.64) | RAB9ANPC1GRM5SMN1; SMN2TSHR | |
| SCHEMBL1544343 | 0.75 | RAB9A (0.52) | RAB9ANPC1GRM5SMN1; SMN2TSHR | |
| SCHEMBL843396 | 0.75 | RAB9A (0.49) | RAB9ANPC1GRM5SMN1; SMN2TSHR | |
| SCHEMBL13882259 | 0.74 | RAB9A (0.77) | RAB9ANPC1GRM5SMN1; SMN2TSHR |
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-2499146-B1 | TRICYCLIC PYRAZOL AMINE DERIVATIVES | MERCK SERONO SA (CH) | 2016-09-21 | — | — | EP | disclosed |
| WO-2011058149-A1 | TRICYCLIC PYRAZOL AMINE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-05-19 | — | — | WO | disclosed |