Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.37 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.37 |
| ▸ | FPR1 | P21462 | 2/20 | 0.36 |
| ▸ | FPR2 | P25090 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6981035 | 0.96 | DPP8 (0.36) | ALDH1A1GAASMN1; SMN2DPP8DPP9 | |
| SCHEMBL6978509 | 0.86 | PTGER4 (0.40) | ALDH1A1GAASMN1; SMN2DPP8DPP9 | |
| SCHEMBL6985322 | 0.86 | GAA (0.41) | ALDH1A1GAAFPR1FPR2HDAC1 | |
| SCHEMBL6985566 | 0.86 | PARP14 (0.40) | ALDH1A1SMN1; SMN2DPP8DPP9FPR1 | |
| SCHEMBL6982945 | 0.85 | NR3C1 (0.36) | ALDH1A1GAASMN1; SMN2DPP8DPP9 | |
| SCHEMBL6986437 | 0.84 | PTGER4 (0.41) | ALDH1A1SMN1; SMN2DPP8DPP9FPR1 | |
| SCHEMBL6984039 | 0.84 | TP53 (0.45) | ALDH1A1GAANR3C1ARMAPT | |
| SCHEMBL6977498 | 0.84 | CCKBR (0.44) | ALDH1A1GAAHDAC1HDAC8HDAC6 | |
| SCHEMBL6984759 | 0.83 | LMNA (0.47) | ALDH1A1GAASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL6982761 | 0.83 | HDAC1 (0.35) | ALDH1A1GAASMN1; SMN2DPP8DPP9 |
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 |