Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.54 |
| ▸ | FOLH1 | Q04609 | 3/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | F2 | P00734 | 2/20 | 0.48 |
| ▸ | F10 | P00742 | 2/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.48 |
| ▸ | F7 | P08709 | 2/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.48 |
| ▸ | F3 | P13726 | 1/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | LDHA | P00338 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL9510591 | 1.00 | ACHE (0.54) | ACHEFOLH1BLMNPSR1TSHR | |
| SCHEMBL9510589 | 1.00 | ACHE (0.54) | ACHEFOLH1BLMNPSR1TSHR | |
| SCHEMBL31724343 | 0.87 | KDM4E (0.48) | ACHEFOLH1BLMNPSR1TSHR | |
| SCHEMBL3812435 | 0.87 | KDM4E (0.48) | ACHEFOLH1BLMNPSR1TSHR | |
| SCHEMBL31500691 | 0.81 | HPGD (0.63) | ACHEHPGDSMN1; SMN2CA1CA2 | |
| SCHEMBL31500690 | 0.81 | HPGD (0.63) | ACHEHPGDSMN1; SMN2CA1CA2 | |
| SCHEMBL9510581 | 0.79 | L3MBTL1 (0.50) | ACHEHPGDSMN1; SMN2 | |
| SCHEMBL187138 | 0.78 | NPSR1 (0.75) | ACHEBLMNPSR1TSHRHPGD | |
| SCHEMBL187137 | 0.78 | NPSR1 (0.75) | ACHEBLMNPSR1TSHRHPGD | |
| SCHEMBL28063668 | 0.78 | ACHE (0.65) | ACHEBLMNPSR1TSHRHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0254545-B1 | DIAMINE COMPOUNDS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-10-06 | — | — | EP | disclosed |
| EP-0254545-A2 | Diamine compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-01-27 | — | — | EP | disclosed |