Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | FAAH | O00519 | 2/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL651830 | 0.82 | PKM (0.76) | MAPK1PKMKDM4ETDP1KMT2A | |
| SCHEMBL7761689 | 0.82 | FAAH (0.50) | MAPK1PKMKDM4ETDP1KMT2A | |
| SCHEMBL2398664 | 0.81 | ALDH1A1 (0.65) | MAPK1PKMKDM4ETDP1KMT2A | |
| SCHEMBL30576791 | 0.81 | ALDH1A1 (0.65) | MAPK1PKMKDM4ETDP1KMT2A | |
| SCHEMBL7761696 | 0.81 | PKM (0.50) | MAPK1PKMKDM4ETDP1KMT2A | |
| SCHEMBL7760048 | 0.80 | MAPT (0.50) | MAPK1PKMKDM4ETDP1KMT2A | |
| SCHEMBL8366817 | 0.79 | BRD4 (0.59) | KDM4EKMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL7760029 | 0.75 | NPC1 (0.67) | PKMKDM4EKMT2AMEN1MAPT | |
| SCHEMBL4671486 | 0.75 | FAAH (0.67) | MAPTSMN1; SMN2FAAHALDH1A1LMNA | |
| SCHEMBL5458965 | 0.74 | MAPT (0.79) | KMT2AMEN1MAPTSMN1; SMN2FAAH |
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 |
|---|---|---|---|---|---|---|---|
| US-6541479-B1 | Derivatives of thiosalicylic acid and o-aminobenzoic acid | MASSACHUSETTS COLLEGE OF PHARMACY | 2003-04-01 | — | — | US | disclosed |
| US-6541479-B1 | Derivatives of thiosalicylic acid and o-aminobenzoic acid | MASSACHUSETTS COLLEGE OF PHARMACY | 2003-04-01 | — | — | US | disclosed |