Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9320342 | 0.91 | ESR1 (0.48) | ESR1PDCD1ESR2CD274MAPT | |
| SCHEMBL10712966 | 0.84 | HPGD (0.56) | ESR1PDCD1ESR2CD274MAPT | |
| SCHEMBL44533 | 0.83 | — | — | |
| SCHEMBL146509 | 0.83 | ESR1 (0.55) | ESR1PDCD1ESR2CD274ALDH1A1 | |
| SCHEMBL4668638 | 0.82 | TSHR (0.56) | ESR1PDCD1ESR2CD274ALDH1A1 | |
| Hydrochloric Acid SCHEMBL2866389 | 0.80 | MAPT (0.50) | MAPTALDH1A1RECQLHSD17B10TSHR | |
| Ammonia Solution, Strong SCHEMBL7995783 | 0.80 | ESR1 (0.52) | ESR1PDCD1ESR2CD274ALDH1A1 | |
| SCHEMBL15960970 | 0.77 | HPGD (0.65) | MAPTALDH1A1RECQLHSD17B10TSHR | |
| Isobutyraldehyde SCHEMBL1140264 | 0.76 | MAPT (0.41) | MAPTALDH1A1RECQLHSD17B10TSHR | |
| SCHEMBL6548061 | 0.75 | ESR1 (0.48) | ESR1PDCD1ESR2CD274CHRNA7 |
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-3901162-A1 | GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF | AbbVie Inc. (US) | 2021-10-27 | — | — | EP | disclosed |
| WO-2017207776-A1 | SYSTEM FOR DISPENSING A COSMETIC PRODUCT | L'OREAL (FR) | 2017-12-07 | — | — | WO | disclosed |