Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.40 |
| ▸ | TUBB | P07437 | 2/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.40 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.40 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.40 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.40 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.40 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.40 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.40 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.40 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.40 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL246387 | 0.84 | MEN1 (0.42) | PIN1MEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL168495 | 0.84 | PIN1 (0.50) | PIN1MEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL28926222 | 0.82 | PIN1 (0.53) | PIN1MEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL246700 | 0.74 | PDGFRB (0.49) | PIN1ALDH1A1TDP1PDGFRBPDGFRA | |
| SCHEMBL29744240 | 0.74 | PDGFRB (0.49) | PIN1ALDH1A1TDP1PDGFRBPDGFRA | |
| SCHEMBL24716166 | 0.74 | ALDH1A1 (0.41) | PIN1MEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL30122585 | 0.74 | MAPT (0.36) | PIN1MEN1KMT2AALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL26102510 | 0.73 | PDGFRB (0.48) | PIN1ALDH1A1TDP1PDGFRBPDGFRA | |
| SCHEMBL2766454 | 0.72 | ALDH1A1 (0.50) | PIN1MEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL25231084 | 0.72 | PIN1 (0.49) | PIN1KMT2AALDH1A1MAPTLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2588457-B1 | PYRAZOLOQUINOLINE DERIVATIVES AS DNA-PK INHIBITORS | MERCK PATENT GMBH (DE) | 2014-11-05 | — | — | EP | disclosed |
| EP-2588457-A1 | PYRAZOLO-QUINOLINES | Merck Patent GmbH (DE) | 2013-05-08 | — | — | EP | disclosed |
| WO-2012000632-A1 | PYRAZOLO-QUINOLINES | MERCK PATENT GMBH (DE) | 2012-01-05 | — | — | WO | disclosed |