Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 3/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.37 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6981829 | 0.92 | POLB (0.39) | ALDH1A1TSHRKMT2AMEN1HPGD | |
| SCHEMBL7410532 | 0.87 | CHRM2 (0.41) | ALDH1A1TSHRSMN1; SMN2KMT2AKDM4E | |
| SCHEMBL6985353 | 0.85 | ALDH1A1 (0.46) | ALDH1A1TSHRGAASMN1; SMN2KMT2A | |
| SCHEMBL6985248 | 0.82 | MAPT (0.42) | ALDH1A1TSHRGAASMN1; SMN2KMT2A | |
| SCHEMBL6977399 | 0.82 | PTGER4 (0.42) | ALDH1A1TSHRGAASMN1; SMN2KMT2A | |
| SCHEMBL6987041 | 0.80 | CDK1 (0.45) | FKBP1AALDH1A1TSHRGAASMN1; SMN2 | |
| SCHEMBL6986544 | 0.80 | PTGER4 (0.39) | ALDH1A1TSHRGAASMN1; SMN2KMT2A | |
| SCHEMBL6979727 | 0.80 | TSHR (0.40) | ALDH1A1TSHRSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL6980417 | 0.80 | PTGER4 (0.39) | ALDH1A1TSHRGAASMN1; SMN2KMT2A | |
| SCHEMBL6977743 | 0.79 | PTGER4 (0.46) | ALDH1A1TSHRKMT2AMEN1HPGD |
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 |