Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 8/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6984550 | 1.00 | NR3C1 (0.56) | NR3C1ALDH1A1MEN1RAB9AKMT2A | |
| Hydrochloric Acid SCHEMBL6984889 | 0.85 | NR3C1 (0.56) | NR3C1ALDH1A1MEN1RAB9AKMT2A | |
| SCHEMBL6985366 | 0.84 | NR3C1 (0.66) | NR3C1ALDH1A1RAB9ATP53MAPT | |
| SCHEMBL6984554 | 0.82 | ALDH1A1 (0.44) | NR3C1ALDH1A1MEN1RAB9AKMT2A | |
| SCHEMBL6983044 | 0.80 | NR3C1 (0.58) | NR3C1TP53MAPTLMNAPKM | |
| SCHEMBL6980538 | 0.80 | NR3C1 (0.56) | NR3C1ALDH1A1TP53MAPTLMNA | |
| SCHEMBL6985317 | 0.80 | NR3C1 (0.58) | NR3C1MEN1KMT2ATP53MAPT | |
| SCHEMBL6981758 | 0.79 | NR3C1 (0.56) | NR3C1TP53MAPTLMNAPKM | |
| SCHEMBL6977969 | 0.79 | NR3C1 (0.56) | NR3C1ALDH1A1MEN1KMT2ATP53 | |
| SCHEMBL6982976 | 0.78 | NR3C1 (0.54) | NR3C1TP53MAPTLMNAPKM |
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 |