Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | HPGD | P15428 | 6/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 2/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9218777 | 0.91 | IDO1 (0.51) | IDO1MEN1KMT2ARXFP1GPR35 | |
| SCHEMBL9041814 | 0.82 | NR4A1 (0.51) | IDO1MEN1KMT2ARXFP1GPR35 | |
| SCHEMBL6390634 | 0.80 | CYP2D6 (0.49) | IDO1MEN1KMT2ARXFP1GPR35 | |
| Hydrochloric Acid SCHEMBL9078082 | 0.80 | KDM4E (0.40) | IDO1MEN1KMT2APOLBALDH1A1 | |
| SCHEMBL9077636 | 0.79 | CDK2 (0.47) | MEN1KMT2ARXFP1GPR35POLB | |
| SCHEMBL9038317 | 0.79 | CNR2 (0.45) | IDO1MEN1KMT2APOLBALDH1A1 | |
| SCHEMBL9079764 | 0.78 | KMT2A (0.44) | MEN1KMT2ARXFP1POLBALDH1A1 | |
| SCHEMBL9362663 | 0.77 | HSD17B10 (0.46) | IDO1MEN1KMT2APOLBALDH1A1 | |
| SCHEMBL690407 | 0.75 | NR4A1 (0.57) | IDO1MEN1KMT2ARXFP1GPR35 | |
| SCHEMBL29373697 | 0.75 | NR4A1 (0.57) | IDO1MEN1KMT2ARXFP1GPR35 |
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-5585382-A | ANTICARCINOGENIC AGENTS | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-12-17 | — | — | US | disclosed |
| US-5416089-A | Antitumor agent | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-05-16 | — | — | US | disclosed |