Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 2/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | FBP1 | P09467 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7315333 | 0.90 | ACLY (0.42) | ACLYTDP1ALDH1A1CYP1A2KMT2A | |
| Hydrochloric Acid SCHEMBL7311372 | 0.89 | ACLY (0.41) | ACLYTDP1CYP1A2KMT2AFBP1 | |
| SCHEMBL7317499 | 0.86 | ALDH1A1 (0.35) | ACLYTDP1ALDH1A1PDK1FAAH | |
| SCHEMBL7313318 | 0.85 | ERN1 (0.39) | ALDH1A1FAAHBCHEACHEKMT2A | |
| SCHEMBL7318441 | 0.84 | ALDH1A1 (0.48) | TDP1ALDH1A1CYP1A2VCAM1KMT2A | |
| SCHEMBL7315717 | 0.81 | ACLY (0.38) | ACLYTDP1ALDH1A1VCAM1POLB | |
| SCHEMBL7317383 | 0.79 | ALDH1A1 (0.39) | ALDH1A1CYP1A2KMT2ANPC1RAB9A | |
| SCHEMBL7314687 | 0.78 | ALDH1A1 (0.38) | TDP1ALDH1A1CYP1A2KMT2ANPC1 | |
| SCHEMBL7319279 | 0.77 | ACLY (0.33) | ACLY | |
| SCHEMBL7318092 | 0.77 | ACLY (0.31) | ACLY |
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-4670434-A | ANTICOAGULANT, INOTROPIC AGENT | SYNTEX (U.S.A.) INC. (US) | 1987-06-02 | — | — | US | disclosed |