Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL8338481 | 0.84 | CA12 (0.49) | ALDH1A1POLBTRPV1IDO1KDM4E | |
| SCHEMBL3990479 | 0.81 | HTT (0.49) | ALDH1A1POLBTRPV1KDM4EGAA | |
| SCHEMBL8342672 | 0.78 | ALDH1A1 (0.43) | ALDH1A1POLBTRPV1IDO1KDM4E | |
| SCHEMBL8341123 | 0.76 | NAMPT (0.43) | ALDH1A1POLBIDO1KDM4EGAA | |
| SCHEMBL22414270 | 0.75 | ATM (0.46) | ALDH1A1POLBMTORGAAMEN1 | |
| SCHEMBL8338952 | 0.75 | ALDH1A1 (0.46) | ALDH1A1POLBTRPV1KDM4EGAA | |
| SCHEMBL11754900 | 0.74 | MTOR (0.72) | MTORMEN1KMT2A | |
| SCHEMBL11737069 | 0.73 | MDM4 (0.63) | ALDH1A1POLBTRPV1IDO1KDM4E | |
| SCHEMBL8342447 | 0.73 | ABCC1 (0.53) | ALDH1A1POLBTRPV1GAARAB9A | |
| SCHEMBL8340991 | 0.72 | HDAC3 (0.48) | ALDH1A1POLBTRPV1GAAMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5719320-A | 1,5-BIS(3,3-DIALKYLUREIDO)NAPHTHALENE | HODOGAYA CHEMICAL CO., LTD. (JP) | 1998-02-17 | — | — | US | claimed |
| US-5892111-A | ALKYL-SUBSTITUTED M-BIS/DIMETHYLUREIDO/BENZENES | HODOGAYA CHEMICAL CO., LTD. (JP) | 1999-04-06 | — | — | US | disclosed |
| US-5719320-A | 1,5-BIS(3,3-DIALKYLUREIDO)NAPHTHALENE | HODOGAYA CHEMICAL CO., LTD. (JP) | 1998-02-17 | — | — | US | disclosed |