Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9510573 | 1.00 | ACHE (0.48) | ACHEALDH1A1TSHRRAB9AOPRD1 | |
| SCHEMBL10964449 | 0.81 | ACHE (0.51) | ACHEALDH1A1TSHRRAB9AOPRD1 | |
| SCHEMBL8716961 | 0.81 | KDM4E (0.51) | ALDH1A1HIF1AKDM4EMEN1KMT2A | |
| SCHEMBL6491412 | 0.80 | HRH3 (0.50) | ALDH1A1OPRK1HIF1A | |
| SCHEMBL6491408 | 0.80 | HRH3 (0.50) | ALDH1A1OPRK1HIF1A | |
| SCHEMBL7676784 | 0.80 | HRH3 (0.50) | ALDH1A1OPRK1HIF1A | |
| SCHEMBL19043331 | 0.76 | PPARG (0.52) | ACHEALDH1A1TSHRRAB9AOPRD1 | |
| SCHEMBL22478414 | 0.76 | PPARG (0.52) | ACHEALDH1A1TSHRRAB9AOPRD1 | |
| SCHEMBL8720321 | 0.75 | HRH3 (0.45) | ALDH1A1TSHRRAB9AOPRK1KDM4E | |
| SCHEMBL8717593 | 0.75 | TSHR (0.44) | TSHROPRK1KDM4E |
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 |