Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.35 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GRK2 | P25098 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | THRA | P10827 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL7869141 | 0.81 | KMT2A (0.42) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL1533171 | 0.80 | ALDH1A1 (0.49) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL362973 | 0.80 | BBOX1 (0.53) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL27408419 | 0.79 | ALDH1A1 (0.40) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL5973619 | 0.79 | ALDH1A1 (0.38) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| Hydrochloric Acid SCHEMBL1072129 | 0.79 | ALDH1A1 (0.47) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL9936528 | 0.79 | ALDH1A1 (0.42) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL15303927 | 0.78 | BBOX1 (0.47) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL28657357 | 0.78 | ALDH1A1 (0.37) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL4565040 | 0.78 | BBOX1 (0.44) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A |
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-5981816-A | USING HYDROSOLUBLE NEUTRAL OR POSITIVELY CHARGED HOMOPOLYMERS OR COPOLYMERS, OR POLYAMPHOLYTES, WHICH DERIVE FROM ONE OR MORE NITROGEN-CONTAINING MONOMERS, TO INHIBIT OR RETARD HYDRATE FORMATION, GROWTH | INSTITUT FRANCAIS DU PETROLE (FR) | 1999-11-09 | — | — | US | disclosed |