Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.58 |
| ▸ | ABL1 | P00519 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | GMNN | O75496 | 1/20 | 0.58 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | TUBB | P07437 | 1/20 | 0.58 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | MAOA | P21397 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.58 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.58 |
| ▸ | THPO | P40225 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL11258670 | 0.92 | ABL1 (0.69) | NPC1MAPTABL1LMNANFKB1 | |
| SCHEMBL4204424 | 0.86 | NPC1 (0.64) | NPC1MAPTABL1LMNANFKB1 | |
| Nocodazole SCHEMBL8009081 | 0.83 | ABL1 (0.84) | NPC1MAPTABL1LMNANFKB1 | |
| Nocodazole SCHEMBL29360101 | 0.83 | ABL1 (0.84) | NPC1MAPTABL1LMNANFKB1 | |
| Nocodazole SCHEMBL9477 | 0.83 | ABL1 (0.84) | NPC1MAPTABL1LMNANFKB1 | |
| Nocodazole SCHEMBL7615542 | 0.82 | ABL1 (0.82) | NPC1MAPTABL1LMNANFKB1 | |
| SCHEMBL1108963 | 0.80 | NPC1 (0.54) | NPC1MAPTABL1LMNANFKB1 | |
| Nocodazole SCHEMBL8198291 | 0.79 | ABL1 (0.77) | NPC1MAPTABL1LMNANFKB1 | |
| Nocodazole SCHEMBL8195415 | 0.79 | ABL1 (0.77) | NPC1MAPTABL1LMNANFKB1 | |
| Nocodazole SCHEMBL22418403 | 0.79 | ABL1 (0.76) | NPC1MAPTABL1LMNANFKB1 |
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-4321393-A | Method for preparing 2-cyanamidobenzimidazoles or 2-cyanamidobenzoxazoles | SMITHKLINE CORPORATION (US) | 1982-03-23 | — | — | US | disclosed |
| US-4285878-A | N-Phenyl-N'-cyano-O-phenylisoureas | SMITHKLINE CORPORATION (US) | 1981-08-25 | — | — | US | disclosed |