Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7801403 | 0.79 | TSHR (0.36) | TSHRCYP1A2CYP2C9CYP2C19RAB9A | |
| SCHEMBL8413587 | 0.77 | — | — | |
| SCHEMBL11584096 | 0.76 | TSHR (0.38) | TSHRCYP1A2CYP2C9CYP2C19RAB9A | |
| SCHEMBL28442226 | 0.71 | NPC1 (0.40) | TSHRCYP1A2CYP2C9CYP2C19NPC1 | |
| SCHEMBL3968653 | 0.71 | KMT2A (0.44) | CYP1A2RAB9ANPC1NAPRTHSD17B10 | |
| SCHEMBL3636602 | 0.70 | EPHX1 (0.32) | TSHRRAB9ANAPRTHSD17B10SMN1; SMN2 | |
| SCHEMBL5080048 | 0.69 | TOP2A (0.43) | TSHRRAB9ANPC1NAPRTHSD17B10 | |
| SCHEMBL27478753 | 0.69 | TOP2A (0.43) | TSHRRAB9ANPC1NAPRTHSD17B10 | |
| SCHEMBL5170532 | 0.68 | POLB (0.35) | TSHRCYP1A2HSD17B10POLBMAPT | |
| SCHEMBL29187605 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1999012034-A1 | AMINE COMPOUNDS AND COMBINATORIAL LIBRARIES COMPRISING SAME | ISIS PHARMACEUTICALS, INC. (US) | 1999-03-11 | — | — | WO | disclosed |
| US-4108632-A | Use of phthalanilic acids to regulate the growth of corn plants | MONSANTO COMPANY (US) | 1978-08-22 | — | — | US | disclosed |