Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 1/20 | 0.47 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | TNF | P01375 | 1/20 | 0.43 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.43 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6983746 | 0.87 | NR3C1 (0.47) | NR3C1PTPN11ALDH1A1LMNATSHR | |
| SCHEMBL6986976 | 0.84 | ADRB2 (0.58) | NR3C1ALDH1A1LMNANPSR1MEN1 | |
| SCHEMBL6985290 | 0.83 | ALDH1A1 (0.58) | ALDH1A1LMNAMAPK1CYP2C9MEN1 | |
| SCHEMBL6979722 | 0.83 | TP53 (0.48) | NR3C1ALDH1A1TSHRMAPK1MEN1 | |
| SCHEMBL6984755 | 0.82 | TP53 (0.56) | NR3C1ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL6979462 | 0.82 | MAPT (0.58) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| SCHEMBL7959087 | 0.81 | TP53 (0.48) | NR3C1ALDH1A1TSHRMAPK1MEN1 | |
| SCHEMBL6985865 | 0.81 | MAPT (0.56) | NR3C1ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL6985746 | 0.81 | KMT2A (0.56) | NR3C1ALDH1A1LMNAMAPK1MEN1 | |
| SCHEMBL6982759 | 0.81 | BRD4 (0.53) | NR3C1LMNAMEN1KMT2ATP53 |
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-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |
| US-6300342-B1 | FOR THERAPY OR INHIBITING THROMBUS FORMATION; FOR THERAPY OF FIBRIN-DEPENDENT INFLAMMATORY CONDITION | BOEHRINGER INGELHEIM PHARM KG (DE) | 2001-10-09 | — | — | US | disclosed |