Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | SHBG | P04278 | 1/20 | 0.33 |
| ▸ | ADH1A | P07327 | 2/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL8955128 | 1.00 | CYP1A2 (0.37) | CYP1A2SHBGADH1AADH1CCA1 | |
| SCHEMBL3898081 | 1.00 | CYP1A2 (0.37) | CYP1A2SHBGADH1AADH1CCA1 | |
| SCHEMBL8955288 | 0.97 | CYP1A2 (0.33) | CYP1A2CA1CA2CA4 | |
| SCHEMBL8955874 | 0.92 | — | — | |
| SCHEMBL8955858 | 0.86 | — | — | |
| SCHEMBL2286650 | 0.81 | ALDH1A1 (0.32) | — | |
| SCHEMBL8955562 | 0.80 | CYP1A2 (0.39) | CYP1A2SHBGCA1CA2CA4 | |
| SCHEMBL8955104 | 0.80 | CYP1A2 (0.39) | CYP1A2SHBGCA1CA2CA4 | |
| SCHEMBL8956015 | 0.80 | CYP1A2 (0.39) | CYP1A2SHBGCA1CA2CA4 | |
| SCHEMBL3886443 | 0.79 | SHBG (0.33) | CYP1A2SHBGADH1AADH1CCA1 |
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-5484685-A | Naphthalocyanine derivatives, production thereof, optical recording medium using the same, and production thereof | HITACHI, LTD. (JP) | 1996-01-16 | — | — | US | disclosed |
| EP-0366440-B1 | Naphthalocyanine derivatives, production thereof, optical recording medium using the same, and production thereof | HITACHI CHEMICAL CO LTD (JP) | 1994-06-08 | — | — | EP | disclosed |
| EP-0366440-A2 | Naphthalocyanine derivatives, production thereof, optical recording medium using the same, and production thereof | Hitachi Chemical Co., Ltd. (JP) | 1990-05-02 | — | — | EP | disclosed |