Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | CTSG | P08311 | 1/20 | 0.41 |
| ▸ | CMA1 | P23946 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6096331 | 0.78 | STAT3 (0.51) | ALDH1A1KDM4EMEN1KMT2AATM | |
| SCHEMBL29378424 | 0.77 | ACHE (0.50) | CA1CA2ACHEALDH1A1TNF | |
| SCHEMBL30990182 | 0.75 | ACHE (0.54) | CA1CA2ACHEALDH1A1TNF | |
| SCHEMBL6093053 | 0.74 | KMT2A (0.57) | ALDH1A1KDM4EMEN1KMT2AATM | |
| SCHEMBL7331445 | 0.74 | ALDH1A1 (0.51) | CA12CA1CA2CA14CTSG | |
| SCHEMBL29501713 | 0.73 | KDM4E (0.47) | ABCB1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL4684928 | 0.73 | CA12 (0.55) | CA12CA1CA2CA14CTSG | |
| SCHEMBL2404190 | 0.73 | TNF (0.54) | CA1CA2ACHEALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL8959813 | 0.73 | ALDH1A1 (0.50) | CA12CA1CA2CA14CTSG | |
| SCHEMBL10565188 | 0.72 | ACHE (0.52) | CA12CA1CA2CA14ACHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023086696-A2 | APPARATUS AND METHODS FOR CONTINUOUS FLOW SYNTHESIS OF CISATRACURIUM | ODH IP Corp. (US) | 2023-05-19 | — | — | WO | disclosed |