Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | TNFSF11 | O14788 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GALR2 | O43603 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9037585 | 0.90 | PARP1 (0.48) | ALDH1A1HPGDKDRKDM4EMAPT | |
| SCHEMBL9038022 | 0.89 | GFER (0.53) | ALDH1A1HPGDKDRGFERHDAC1 | |
| SCHEMBL9038139 | 0.89 | ALDH1A1 (0.48) | ALDH1A1HPGDKDRKDM4EMAPT | |
| SCHEMBL9038015 | 0.88 | ALDH1A1 (0.47) | ALDH1A1HPGDKDRKDM4EMAPT | |
| SCHEMBL9037527 | 0.87 | ALDH1A1 (0.48) | ALDH1A1HPGDKDRKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL9001495 | 0.87 | ALDH1A1 (0.46) | ALDH1A1HPGDKDRKDM4EMAPT | |
| SCHEMBL9036400 | 0.85 | ADRA2A (0.53) | ALDH1A1HPGDKDRKDM4EMAPT | |
| SCHEMBL8985824 | 0.82 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4EMAPTHSD17B10 | |
| SCHEMBL9036223 | 0.82 | ADRA2A (0.43) | ALDH1A1HPGDKDRKDM4EMAPT | |
| SCHEMBL8985882 | 0.80 | PARP1 (0.49) | ALDH1A1HPGDKDM4EHSD17B10TNFSF11 |
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-0507861-B1 | DIAROMATIC SUBSTITUTED ANTI-AIDS COMPOUNDS | UPJOHN CO (US) | 1996-09-11 | — | — | EP | claimed |
| WO-1991009849-A1 | DIAROMATIC SUBSTITUTED ANTI-AIDS COMPOUNDS | THE UPJOHN COMPANY (US) | 1991-07-11 | — | — | WO | claimed |