Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | EP300 | Q09472 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6985246 | 0.83 | TP53 (0.51) | TP53MAPTSMN1; SMN2NPC1MAPK1 | |
| SCHEMBL6977395 | 0.81 | TP53 (0.46) | TP53MAPTSMN1; SMN2NPC1MAPK1 | |
| SCHEMBL6977738 | 0.81 | TP53 (0.51) | TP53MAPTSMN1; SMN2NPC1MAPK1 | |
| Hydrochloric Acid SCHEMBL7083530 | 0.80 | PARP1 (0.39) | MAPTSMN1; SMN2NPC1MAPK1RAB9A | |
| SCHEMBL6984356 | 0.79 | SMN1; SMN2 (0.53) | TP53MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL6978699 | 0.79 | POLB (0.48) | TP53MAPTSMN1; SMN2NPC1MAPK1 | |
| SCHEMBL6980414 | 0.78 | TP53 (0.44) | TP53MAPTSMN1; SMN2NPC1MAPK1 | |
| SCHEMBL6984354 | 0.78 | PTGER4 (0.49) | TP53MAPTHDAC1HDAC8HDAC6 | |
| SCHEMBL6977210 | 0.78 | TP53 (0.41) | TP53MAPTSMN1; SMN2NPC1MAPK1 | |
| SCHEMBL7958428 | 0.77 | MEN1 (0.46) | TP53MAPTSMN1; SMN2NPC1MAPK1 |
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-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |
| EP-0991624-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | Boehringer Ingelheim Pharma KG (DE) | 2000-04-12 | — | — | EP | disclosed |
| WO-1999000371-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-01-07 | — | — | WO | disclosed |