Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7446492 | 0.85 | CYP2A13 (0.61) | ALDH1A1CYP2A13KDM4ETDP1HRH3 | |
| SCHEMBL4421520 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CYP2A13KDM4ETDP1HRH3 | |
| SCHEMBL6173652 | 0.79 | KMT2A (0.42) | TSHRALDH1A1L3MBTL1CYP2A13KDM4E | |
| SCHEMBL2343088 | 0.79 | ACHE (0.47) | TSHRGFERALDH1A1L3MBTL1KDM4E | |
| SCHEMBL27081642 | 0.75 | KDM4E (0.48) | ALDH1A1RECQLKDM4ETDP1SMN1; SMN2 | |
| SCHEMBL220284 | 0.75 | MEN1 (0.53) | TSHRALDH1A1L3MBTL1KDM4ETDP1 | |
| SCHEMBL7447200 | 0.73 | CYP2A13 (0.70) | TSHRGFERALDH1A1L3MBTL1RECQL | |
| SCHEMBL28233781 | 0.72 | ALDH1A1 (0.38) | TSHRGFERALDH1A1KDM4EHRH3 | |
| SCHEMBL14660641 | 0.72 | SIGMAR1 (0.50) | ALDH1A1CYP2A13KDM4ETDP1SMN1; SMN2 | |
| SCHEMBL18356563 | 0.72 | ALDH1A1 (0.71) | TSHRGFERALDH1A1L3MBTL1RECQL |
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-0863755-A4 | ANTITHROMBOTIC DIAMINES | LILLY CO ELI (US) | 1999-01-20 | — | — | EP | disclosed |
| EP-0863755-A1 | ANTITHROMBOTIC DIAMINES | ELI LILLY AND COMPANY (US) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997025033-A1 | ANTITHROMBOTIC DIAMINES | ELI LILLY AND COMPANY (US) | 1997-07-17 | — | — | WO | disclosed |