Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | RXRB | P28702 | 1/20 | 0.40 |
| ▸ | RXRG | P48443 | 1/20 | 0.40 |
| ▸ | AOC2 | O75106 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4451541 | 0.81 | ALDH1A1 (0.50) | ALDH1A1GLAKDM4ECYP1A2NOTUM | |
| SCHEMBL19189093 | 0.79 | ALDH1A1 (0.47) | ALDH1A1GLAKDM4ECYP1A2NOTUM | |
| SCHEMBL10999440 | 0.77 | ALDH1A1 (0.46) | ALDH1A1GLAKDM4ECYP1A2NOTUM | |
| SCHEMBL14615037 | 0.76 | DHFR (0.50) | ALDH1A1GLAKDM4ECYP1A2NOTUM | |
| SCHEMBL11013902 | 0.74 | ALDH1A1 (0.42) | ALDH1A1MEN1KMT2ALMNATDP1 | |
| SCHEMBL29703117 | 0.73 | ALDH1A1 (0.46) | ALDH1A1GLAKDM4ECYP1A2NOTUM | |
| SCHEMBL213521 | 0.73 | ALDH1A1 (0.46) | ALDH1A1GLAKDM4ECYP1A2NOTUM | |
| SCHEMBL16539829 | 0.72 | KDM4E (0.47) | ALDH1A1GLAKDM4ECYP1A2NOTUM | |
| SCHEMBL5213657 | 0.72 | PIM1 (0.47) | ALDH1A1GLAKDM4ECYP1A2NOTUM | |
| Hydrochloric Acid SCHEMBL1474850 | 0.71 | PIM1 (0.46) | ALDH1A1GLAKDM4ECYP1A2NOTUM |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4165384-A | ADRENERGIC BLOCKING AGENTS, CARDIOVASCULAR DISORDERS | AKTIEBOLAGET HASSLE (SE) | 1979-08-21 | — | — | US | disclosed |