Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.36 |
| ▸ | OXTR | P30559 | 1/20 | 0.36 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.36 |
| ▸ | FPR1 | P21462 | 2/20 | 0.36 |
| ▸ | FPR2 | P25090 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6987049 | 0.92 | FKBP1A (0.42) | TDP1PTGER4MEN1ALDH1A1HPGD | |
| SCHEMBL7410532 | 0.90 | CHRM2 (0.41) | POLBNPC1TDP1PTGER4MEN1 | |
| SCHEMBL6985353 | 0.87 | ALDH1A1 (0.46) | NPC1PTGER4MEN1USP2ALDH1A1 | |
| SCHEMBL6985248 | 0.84 | MAPT (0.42) | NPC1PTGER4MEN1USP2ALDH1A1 | |
| SCHEMBL6977399 | 0.84 | PTGER4 (0.42) | NPC1TDP1NAAAPTGER4MEN1 | |
| SCHEMBL6986544 | 0.83 | PTGER4 (0.39) | NPC1PTGER4MEN1USP2ALDH1A1 | |
| SCHEMBL6979727 | 0.83 | TSHR (0.40) | NPC1PTGER4MEN1USP2ALDH1A1 | |
| SCHEMBL6980417 | 0.82 | PTGER4 (0.39) | NPC1TDP1NAAAPTGER4MEN1 | |
| SCHEMBL6977743 | 0.81 | PTGER4 (0.46) | POLBPTGER4MEN1USP2ALDH1A1 | |
| SCHEMBL6979177 | 0.81 | CCR5 (0.39) | NPC1PTGER4MEN1USP2ALDH1A1 |
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 |