Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 5/20 | 0.48 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.47 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KIT | P10721 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | PDE1A | P54750 | 1/20 | 0.41 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 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 | |
|---|---|---|---|---|
| SCHEMBL8713187 | 0.86 | NR3C1 (0.52) | BRD4AURKAKDRAURKBNR3C1 | |
| SCHEMBL20372960 | 0.81 | BRD4 (0.51) | BRD4AURKAKDRAURKBHPGD | |
| SCHEMBL5945125 | 0.80 | NR3C1 (0.68) | NR3C1ALDH1A1HSD17B10LMNAHTT | |
| SCHEMBL29407201 | 0.80 | NR3C1 (0.68) | NR3C1ALDH1A1HSD17B10LMNAHTT | |
| SCHEMBL6666233 | 0.80 | NR3C1 (0.47) | NR3C1ALDH1A1LMNAMEN1HTT | |
| SCHEMBL10345020 | 0.79 | BRD4 (0.52) | BRD4AURKAKDRAURKBHPGD | |
| SCHEMBL14583304 | 0.79 | BRD4 (0.52) | BRD4AURKAKDRAURKBHPGD | |
| SCHEMBL8861660 | 0.79 | BRD4 (0.52) | BRD4AURKAKDRAURKBHPGD | |
| Hydrochloric Acid SCHEMBL11059615 | 0.79 | NR3C1 (0.67) | NR3C1ALDH1A1HSD17B10LMNAHTT | |
| SCHEMBL9478958 | 0.79 | NR3C2 (0.47) | BRD4AURKAKDRAURKBNR3C1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4180503-A | FOR DYEING POLYAMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1979-12-25 | — | — | US | disclosed |
| US-4124581-A | FOR NATURAL AND SYNTHETIC FIBERS, COLORFAST | BAYER AKTIENGESELLSCHAFT (DE) | 1978-11-07 | — | — | US | disclosed |