Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.67 |
| ▸ | RAB9A | P51151 | 2/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.66 |
| ▸ | LMNA | P02545 | 3/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.66 |
| ▸ | TSHR | P16473 | 3/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.66 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.64 |
| ▸ | MAOA | P21397 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | HTR3A | P46098 | 1/20 | 0.60 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.60 |
| ▸ | BLM | P54132 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | SCN1A | P35498 | 2/20 | 0.57 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL1807523 | 1.00 | NPC1 (0.67) | NPC1RAB9ACYP3A4LMNACYP1A2 | |
| SCHEMBL316710 | 1.00 | NPC1 (0.67) | NPC1RAB9ACYP3A4LMNACYP1A2 | |
| SCHEMBL291777 | 0.94 | NPC1 (0.73) | NPC1RAB9ACYP3A4LMNACYP1A2 | |
| SCHEMBL7892734 | 0.93 | NPC1 (0.59) | NPC1RAB9ACYP3A4LMNACYP1A2 | |
| SCHEMBL11228191 | 0.91 | CYP3A4 (0.61) | NPC1RAB9ACYP3A4LMNACYP1A2 | |
| SCHEMBL11225762 | 0.91 | CYP3A4 (0.61) | NPC1RAB9ACYP3A4LMNACYP1A2 | |
| SCHEMBL11412546 | 0.91 | CYP3A4 (0.61) | NPC1RAB9ACYP3A4LMNACYP1A2 | |
| SCHEMBL4799894 | 0.91 | CYP3A4 (0.61) | NPC1RAB9ACYP3A4LMNACYP1A2 | |
| SCHEMBL14097392 | 0.90 | NPC1 (0.56) | NPC1RAB9ACYP3A4LMNACYP1A2 | |
| SCHEMBL16573654 | 0.90 | NPC1 (0.56) | NPC1RAB9ACYP3A4LMNACYP1A2 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-54080397-A | — | — | None | — | — | JP | disclosed |
| EP-0328585-B1 | METABOLICALLY ACCEPTABLE POLYISOCYANATE ADHESIVES | BIORESEARCH INC (US) | 1994-09-07 | — | — | EP | disclosed |
| EP-0328585-A4 | METABOLICALLY ACCEPTABLE POLYISOCYANATE ADHESIVES | — | 1991-06-05 | — | — | EP | disclosed |
| EP-0328585-A1 | METABOLICALLY ACCEPTABLE POLYISOCYANATE ADHESIVES | BIORESEARCH INC. (US) | 1989-08-23 | — | — | EP | disclosed |
| US-4829099-A | SURGERY, POLYISOCYANATES, POLYISOTHIOCYANATES | BIORESEARCH, INC. (US) | 1989-05-09 | — | — | US | disclosed |
| WO-1989000589-A1 | METABOLICALLY ACCEPTABLE POLYISOCYANATE ADHESIVES | BIORESEARCH, INC. (US) | 1989-01-26 | — | — | WO | disclosed |
| US-4327204-A | Process for producing polyurethane elastomer by mixing a hardener composition with an isocyanate composition | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1982-04-27 | — | — | US | disclosed |
| US-4246392-A | Method for the preparation of polyurethane elastomers based on polyethyleneglycol-bis(4-aminobenzoates) | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1981-01-20 | — | — | US | disclosed |
| JP-S5480397-A | PRODUCTION OF POLYURETHANE ELASTOMER | IHARA CHEM IND CO LTD | 1979-06-27 | — | — | JP | disclosed |