Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 2/20 | 0.31 |
| ▸ | NOS1 | P29475 | 2/20 | 0.31 |
| ▸ | NOS2 | P35228 | 2/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1009278 | 0.89 | MIF (0.44) | MIFTSHRTDP1NOS3NOS1 | |
| SCHEMBL707583 | 0.78 | CYP3A4 (0.34) | TSHR | |
| Methacrylic Acid SCHEMBL26103967 | 0.75 | ALDH1A1 (0.37) | MIFNOS3NOS1 | |
| SCHEMBL4956648 | 0.74 | CYP3A4 (0.32) | MIF | |
| SCHEMBL30108401 | 0.74 | CYP3A4 (0.32) | MIF | |
| SCHEMBL2766190 | 0.73 | MIF (0.41) | MIFNOS3NOS1NOS2TRPA1 | |
| SCHEMBL2045539 | 0.72 | MIF (0.48) | MIFNOS3NOS1TRPA1 | |
| SCHEMBL11160278 | 0.71 | CYP3A4 (0.46) | MIFMAOAMAOBTRPA1NOTUM | |
| SCHEMBL18245040 | 0.71 | NOS3 (0.36) | TSHRTDP1NOS3NOS1NOS2 | |
| Phenylisothiocyanate SCHEMBL22396351 | 0.71 | MIF (0.74) | MIFTSHRNAPRTTDP1MAOA |
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-0718300-B1 | Carbodiimide derivative | NISSHIN SPINNING (JP) | 2001-11-21 | — | — | EP | disclosed |
| US-5789588-A | BIOTIN DERIVATIIVES OF CARBODIIMIDE FOR NUCLEIC ACIDS AND PROTEINS | NISSHINBO INDUSTRIES, INC. (JP) | 1998-08-04 | — | — | US | disclosed |
| EP-0718300-A1 | Carbodiimide derivative | NISSHINBO INDUSTRIES, INC. (JP) | 1996-06-26 | — | — | EP | disclosed |