Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | AGXT | P21549 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 6/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9162557 | 0.81 | HTR2A (0.44) | KDM4ESMN1; SMN2IDO1AGXT | |
| SCHEMBL11543509 | 0.81 | TP53 (0.50) | SMN1; SMN2NPC1RAB9A | |
| SCHEMBL9155660 | 0.78 | HTR2A (0.41) | KDM4ESMN1; SMN2IDO1AGXTDAO | |
| SCHEMBL10500678 | 0.77 | ALDH1A1 (0.52) | KDM4EIDO1NPC1ALDH1A1 | |
| SCHEMBL14822757 | 0.77 | CYP3A4 (0.48) | KDM4ESMN1; SMN2IDO1AGXTACHE | |
| SCHEMBL16946121 | 0.77 | CYP19A1 (0.63) | CYP19A1 | |
| SCHEMBL2095740 | 0.71 | KDM4E (0.52) | KDM4ESMN1; SMN2IDO1AGXTACHE | |
| SCHEMBL7700904 | 0.71 | IDO1 (0.58) | KDM4ESMN1; SMN2IDO1AGXTDAO | |
| SCHEMBL6087034 | 0.71 | PPARG (0.56) | KDM4E | |
| SCHEMBL3298107 | 0.71 | IDO1 (0.58) | KDM4ESMN1; SMN2IDO1AGXTDAO |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0401166-B1 | Nitrogen-containing titanocenes and their use | CIBA GEIGY AG (CH) | 1995-02-22 | — | — | EP | disclosed |
| EP-0401167-B1 | Process for the preparation of titanocenes with o,o'-difluoro ligands | CIBA GEIGY AG (CH) | 1994-06-08 | — | — | EP | disclosed |
| US-5075467-A | Reacting organotitanium halide with lithium amide | CIBA-GEIGY CORPORATION (US) | 1991-12-24 | — | — | US | disclosed |
| US-5068371-A | Photoinitiators for polymerization | CIBA-GEIGY CORPORATION (US) | 1991-11-26 | — | — | US | disclosed |
| EP-0401166-A2 | Nitrogen-containing titanocenes and their use | CIBA-GEIGY AG (CH) | 1990-12-05 | — | — | EP | disclosed |
| EP-0401167-A2 | Process for the preparation of titanocenes with o,o'-difluoro ligands | CIBA-GEIGY AG (CH) | 1990-12-05 | — | — | EP | disclosed |