Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.43 |
| ▸ | ITGAV | P06756 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16353618 | 0.77 | TSHR (0.54) | KDM4EKMT2ASMN1; SMN2GAATHRB | |
| SCHEMBL1965855 | 0.77 | ALDH1A1 (0.55) | KDM4EALDH1A1KMT2AHPGDMEN1 | |
| SCHEMBL30775403 | 0.77 | ALDH1A1 (0.55) | KDM4EALDH1A1KMT2AHPGDMEN1 | |
| SCHEMBL243759 | 0.75 | ITGB3 (0.63) | ALDH1A1KMT2AHPGDMEN1SMN1; SMN2 | |
| SCHEMBL16353734 | 0.75 | MAPK1 (0.49) | KDM4EALDH1A1KMT2AGAATHRB | |
| SCHEMBL17713262 | 0.74 | CA1 (0.52) | KDM4EALDH1A1KMT2AHPGDMEN1 | |
| Hydrochloric Acid SCHEMBL14914649 | 0.74 | ITGB3 (0.61) | ALDH1A1KMT2AHPGDMEN1SMN1; SMN2 | |
| SCHEMBL7511801 | 0.74 | CYP2C9 (0.46) | KDM4EALDH1A1KMT2AHPGDSMN1; SMN2 | |
| SCHEMBL10670706 | 0.73 | KDM4E (0.55) | KDM4EALDH1A1KMT2AHPGDMEN1 | |
| SCHEMBL3190815 | 0.73 | ALDH1A1 (0.50) | KDM4EALDH1A1KMT2AHPGDMEN1 |
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-6011152-A | REACTING STOICHIOMETRIC AMOUNTS OR MORE OF AN AMINO CARBOXYLIC ACID OR A PROTECTED/ACTIVATED FOR THEREOF WITH AN ACTIVATED DERVATIVE SELECTED FROM THE GROUP CONSISTING OF OXALATES AND MALONATES IN THE PRESENCE OF A SOLVENT AND HEAT | CARNEGIE MELLON UNIVERSITY (US) | 2000-01-04 | — | — | US | disclosed |