Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | G6PD | P11413 | 1/20 | 0.49 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.48 |
| ▸ | CDC7 | O00311 | 5/20 | 0.47 |
| ▸ | DBF4 | Q9UBU7 | 5/20 | 0.47 |
| ▸ | TP53 | P04637 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.44 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29569289 | 1.00 | TSHR (0.51) | TSHRG6PDCTNNB1CDC7DBF4 | |
| SCHEMBL9621609 | 0.80 | NOTUM (0.36) | TSHRCTNNB1CDC7DBF4 | |
| SCHEMBL9621465 | 0.74 | PDPK1 (0.47) | TSHRCTNNB1CDC7DBF4TP53 | |
| SCHEMBL3396404 | 0.70 | TSHR (0.78) | TSHRG6PDCTNNB1CDC7DBF4 | |
| SCHEMBL31606731 | 0.68 | G6PD (1.00) | TSHRG6PDCDC7DBF4TP53 | |
| SCHEMBL2888994 | 0.68 | G6PD (1.00) | TSHRG6PDCDC7DBF4TP53 | |
| SCHEMBL8696237 | 0.68 | TSHR (0.72) | TSHRCTNNB1CDC7DBF4TP53 | |
| SCHEMBL10923675 | 0.66 | LMNA (0.68) | TSHRCTNNB1CDC7DBF4HSD17B10 | |
| Buthiopurine SCHEMBL10380092 | 0.65 | PAK1 (0.66) | TSHRG6PDCTNNB1CDC7DBF4 | |
| SCHEMBL240980 | 0.65 | HSD17B10 (1.00) | TSHRG6PDCDC7DBF4TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0186454-B1 | 6-PURINYL N-(2-CHLOROETHYL) CARBAMATE AND THIOCARBAMATE, A PROCESS FOR THEIR PREPARATION AND USE THEREOF | SPOFA Spojené Podniky Pro Zdravotnickou Vyrobu (CS) | 1992-04-08 | — | — | EP | claimed |
| US-4720497-A | 6-purinyl N-/2-chloroethyl/carbamate and thiocarbamate and process for the preparation thereof | SPOFA, SPOJENE PODNIKY PRO ZDRAVOTNICKOU VYROBU (CS) | 1988-01-19 | — | — | US | claimed |
| US-4720497-A | 6-purinyl N-/2-chloroethyl/carbamate and thiocarbamate and process for the preparation thereof | SPOFA, SPOJENE PODNIKY PRO ZDRAVOTNICKOU VYROBU (CS) | 1988-01-19 | — | — | US | disclosed |