Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NAAA | Q02083 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 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 | |
|---|---|---|---|---|
| SCHEMBL8955355 | 0.98 | CYP1A2 (0.38) | TSHRCYP1A2SMN1; SMN2NAAACNR2 | |
| SCHEMBL8955062 | 0.98 | CYP1A2 (0.38) | TSHRCYP1A2SMN1; SMN2NAAACNR2 | |
| SCHEMBL8955090 | 0.98 | CYP1A2 (0.38) | TSHRCYP1A2SMN1; SMN2NAAACNR2 | |
| SCHEMBL8955351 | 0.96 | TSHR (0.35) | TSHRCYP1A2SMN1; SMN2NAAAALDH1A1 | |
| SCHEMBL8955660 | 0.92 | TSHR (0.38) | TSHRSMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL8955131 | 0.88 | CA1 (0.30) | — | |
| SCHEMBL8955780 | 0.86 | CYP1A2 (0.31) | CYP1A2NAAA | |
| SCHEMBL8955194 | 0.86 | CYP1A2 (0.31) | CYP1A2NAAA | |
| SCHEMBL8955141 | 0.86 | CYP1A2 (0.31) | CYP1A2NAAA | |
| SCHEMBL8955473 | 0.83 | — | — |
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 |